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Showing metabocard for 10-Formyldihydrofolate (HMDB0006485)

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Record Information
Version5.0
StatusExpected but not Quantified
Creation Date2007-05-23 11:29:59 UTC
Update Date2021-09-14 15:42:11 UTC
HMDB IDHMDB0006485
Secondary Accession Numbers
  • HMDB06485
Metabolite Identification
Common Name10-Formyldihydrofolate
Description10-formyldihydrofolate is a folate compound that has not been found as a component of intracellular folates in normal tissues but has been identified in the cytosol of methotrexate (MTX)-treated MCF-7 breast cancer cells and normal human myeloid precursor cells. The origin of 10-formyldihydrofolate remains an enigma. Its appearance only in the extracts from MTX-treated cells is not consistent with a simple oxidation of lO-formyl-H4folate during the extraction procedure. This, however, does not exclude the occurrence of spontaneous oxidation of 10-formyl-H4folate within the intact cells prior to the folate extraction. (PMID: 3366769 ).
Structure
Data?1582752386
MOL3D MOLSDF3D SDFPDB3D PDBSMILESInChI

MOL for HMDB0006485 (10-Formyldihydrofolate)


  Mrv0541 02231220402D          

 34 36  0  0  1  0            999 V2000
   20.9636   -8.3926    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   22.4021  -10.8621    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   21.6924  -12.1022    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.5411  -10.0481    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.9831  -13.7743    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.0644  -11.3192    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   22.3924   -8.3871    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   20.2603  -11.2828    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   16.6927  -12.5340    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   14.5164  -12.1156    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   14.5164  -13.8228    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   13.0644  -13.7942    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.3499  -12.5567    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.6354  -13.7942    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   20.9700  -10.0426    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.6828   -9.6272    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.9731  -10.8675    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   21.6797   -8.8024    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.6892  -11.2772    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.5442  -10.8730    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.8313  -11.2883    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.8345  -12.1133    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.1153  -10.8786    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.4056  -12.1189    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.1216  -12.5286    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.4024  -11.2939    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.9767  -12.1243    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2638  -12.5396    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.6959  -13.3590    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2638  -13.3989    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7788  -12.5567    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7788  -13.3817    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0644  -12.1442    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3499  -13.3817    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1 18  2  0  0  0  0
  2 19  1  0  0  0  0
  3 19  2  0  0  0  0
  4 20  2  0  0  0  0
  5 29  2  0  0  0  0
  6 33  2  0  0  0  0
  7 18  1  0  0  0  0
 17  8  1  1  0  0  0
  8 20  1  0  0  0  0
  9 24  1  0  0  0  0
  9 27  1  0  0  0  0
  9 29  1  0  0  0  0
 10 28  2  0  0  0  0
 10 31  1  0  0  0  0
 11 30  1  0  0  0  0
 11 32  1  0  0  0  0
 12 32  1  0  0  0  0
 12 34  2  0  0  0  0
 13 33  1  0  0  0  0
 13 34  1  0  0  0  0
 14 34  1  0  0  0  0
 15 16  1  0  0  0  0
 15 17  1  0  0  0  0
 16 18  1  0  0  0  0
 17 19  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  2  0  0  0  0
 21 23  1  0  0  0  0
 22 25  1  0  0  0  0
 23 26  2  0  0  0  0
 24 25  2  0  0  0  0
 24 26  1  0  0  0  0
 27 28  1  0  0  0  0
 28 30  1  0  0  0  0
 31 32  2  0  0  0  0
 31 33  1  0  0  0  0
M  END
Download

3D MOL for HMDB0006485 (10-Formyldihydrofolate)

HMDB0006485
     RDKit          3D
10-Formyldihydrofolate
 55 57  0  0  0  0  0  0  0  0999 V2000
    7.2963    3.6736    0.7812 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.3689    2.8132    0.1726 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3814    1.4962    0.4238 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.5077    0.6280   -0.1395 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5678    1.1240   -1.0073 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5433    2.4680   -1.2732 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6802    2.9125   -2.0677 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.4391    3.2724   -0.6799 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.6743    0.1970   -1.5831 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.6723   -1.0541   -1.3626 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6730   -1.9712   -2.0276 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8651   -2.6713   -1.0780 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.2387   -3.9298   -0.5528 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2907   -4.5257   -0.8697 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6442   -2.0828   -0.6453 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5792   -2.5019   -1.0602 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7060   -1.8605   -0.5762 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6299   -0.8022    0.3199 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7902   -0.1192    0.8440 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6139    0.9158    1.5536 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0948   -0.5700    0.5894 N   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2248    0.1555    1.1368 C   0  0  1  0  0  0  0  0  0  0  0  0
   -6.3165    0.4119    0.1633 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8865    1.2232   -1.0135 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4135    2.5423   -0.5572 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2565    2.8159   -0.1920 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3243    3.6135   -0.5173 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7373   -0.6774    2.2690 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2538   -1.7597    2.6189 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8469   -0.1843    2.9768 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3522   -0.3945    0.7276 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7488   -1.0342    0.2437 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6283   -1.6918   -0.4623 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5320   -0.7554    0.1394 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.2294    3.8124    0.3627 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.0469    4.1702    1.6503 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4311    4.3176   -0.8771 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0167   -1.3804   -2.7128 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2800   -2.6632   -2.6485 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5954   -4.4154    0.1588 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6529   -3.3330   -1.7638 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6758   -2.2208   -0.9314 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2441   -1.4351    0.0022 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8752    1.1046    1.5724 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8064   -0.5380   -0.1553 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.0867    1.0343    0.7045 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0840    0.7216   -1.5945 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7990    1.3826   -1.6594 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.2645    3.4659   -0.1280 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7548    0.3259    3.8460 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2921    0.4372    1.4326 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7390   -0.6924    0.5802 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0097   -2.1731    0.3647 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1900   -2.5252   -0.9621 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.2716   -1.0728    0.8339 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  2  0
  3  4  1  0
  4  5  2  0
  5  6  1  0
  6  7  2  0
  6  8  1  0
  5  9  1  0
  9 10  2  0
 10 11  1  0
 11 12  1  0
 12 13  1  0
 13 14  2  0
 12 15  1  0
 15 16  2  0
 16 17  1  0
 17 18  2  0
 18 19  1  0
 19 20  2  0
 19 21  1  0
 21 22  1  0
 22 23  1  0
 23 24  1  0
 24 25  1  0
 25 26  2  0
 25 27  1  0
 22 28  1  0
 28 29  2  0
 28 30  1  0
 18 31  1  0
 31 32  2  0
 10 33  1  0
 33 34  1  0
  8  2  1  0
 32 15  1  0
 34  4  1  0
  1 35  1  0
  1 36  1  0
  8 37  1  0
 11 38  1  0
 11 39  1  0
 13 40  1  0
 16 41  1  0
 17 42  1  0
 21 43  1  0
 22 44  1  1
 23 45  1  0
 23 46  1  0
 24 47  1  0
 24 48  1  0
 27 49  1  0
 30 50  1  0
 31 51  1  0
 32 52  1  0
 33 53  1  0
 33 54  1  0
 34 55  1  0
M  END
Download

3D SDF for HMDB0006485 (10-Formyldihydrofolate)


  Mrv0541 02231220402D          

 34 36  0  0  1  0            999 V2000
   20.9636   -8.3926    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   22.4021  -10.8621    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   21.6924  -12.1022    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.5411  -10.0481    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.9831  -13.7743    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.0644  -11.3192    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   22.3924   -8.3871    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   20.2603  -11.2828    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   16.6927  -12.5340    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   14.5164  -12.1156    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   14.5164  -13.8228    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   13.0644  -13.7942    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.3499  -12.5567    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.6354  -13.7942    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   20.9700  -10.0426    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.6828   -9.6272    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.9731  -10.8675    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   21.6797   -8.8024    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.6892  -11.2772    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.5442  -10.8730    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.8313  -11.2883    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.8345  -12.1133    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.1153  -10.8786    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.4056  -12.1189    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.1216  -12.5286    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.4024  -11.2939    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.9767  -12.1243    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2638  -12.5396    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.6959  -13.3590    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2638  -13.3989    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7788  -12.5567    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7788  -13.3817    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0644  -12.1442    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3499  -13.3817    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1 18  2  0  0  0  0
  2 19  1  0  0  0  0
  3 19  2  0  0  0  0
  4 20  2  0  0  0  0
  5 29  2  0  0  0  0
  6 33  2  0  0  0  0
  7 18  1  0  0  0  0
 17  8  1  1  0  0  0
  8 20  1  0  0  0  0
  9 24  1  0  0  0  0
  9 27  1  0  0  0  0
  9 29  1  0  0  0  0
 10 28  2  0  0  0  0
 10 31  1  0  0  0  0
 11 30  1  0  0  0  0
 11 32  1  0  0  0  0
 12 32  1  0  0  0  0
 12 34  2  0  0  0  0
 13 33  1  0  0  0  0
 13 34  1  0  0  0  0
 14 34  1  0  0  0  0
 15 16  1  0  0  0  0
 15 17  1  0  0  0  0
 16 18  1  0  0  0  0
 17 19  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  2  0  0  0  0
 21 23  1  0  0  0  0
 22 25  1  0  0  0  0
 23 26  2  0  0  0  0
 24 25  2  0  0  0  0
 24 26  1  0  0  0  0
 27 28  1  0  0  0  0
 28 30  1  0  0  0  0
 31 32  2  0  0  0  0
 31 33  1  0  0  0  0
M  END
> <DATABASE_ID>
HMDB0006485

> <DATABASE_NAME>
hmdb

> <SMILES>
NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C=C3)C(=O)N[C@@H](CCC(O)=O)C(O)=O)CN2)C(=O)N1

> <INCHI_IDENTIFIER>
InChI=1S/C20H21N7O7/c21-20-25-16-15(18(32)26-20)23-11(7-22-16)8-27(9-28)12-3-1-10(2-4-12)17(31)24-13(19(33)34)5-6-14(29)30/h1-4,9,13H,5-8H2,(H,24,31)(H,29,30)(H,33,34)(H4,21,22,25,26,32)/t13-/m0/s1

> <INCHI_KEY>
UXFQDXABPXWSTK-ZDUSSCGKSA-N

> <FORMULA>
C20H21N7O7

> <MOLECULAR_WEIGHT>
471.4234

> <EXACT_MASS>
471.150246061

> <JCHEM_ACCEPTOR_COUNT>
11

> <JCHEM_AVERAGE_POLARIZABILITY>
44.81989917376744

> <JCHEM_BIOAVAILABILITY>
0

> <JCHEM_DONOR_COUNT>
6

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
(2S)-2-[(4-{N-[(2-amino-4-oxo-3,4,7,8-tetrahydropteridin-6-yl)methyl]formamido}phenyl)formamido]pentanedioic acid

> <ALOGPS_LOGP>
-1.26

> <JCHEM_LOGP>
-2.3975139884897843

> <ALOGPS_LOGS>
-3.66

> <JCHEM_MDDR_LIKE_RULE>
1

> <JCHEM_NUMBER_OF_RINGS>
3

> <JCHEM_PHYSIOLOGICAL_CHARGE>
-2

> <JCHEM_PKA>
4.076159587182289

> <JCHEM_PKA_STRONGEST_ACIDIC>
2.961749753741694

> <JCHEM_PKA_STRONGEST_BASIC>
3.5050977269416808

> <JCHEM_POLAR_SURFACE_AREA>
215.88

> <JCHEM_REFRACTIVITY>
124.48600000000002

> <JCHEM_ROTATABLE_BOND_COUNT>
9

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
1.04e-01 g/l

> <JCHEM_TRADITIONAL_IUPAC>
10-formyldihydrofolic acid

> <JCHEM_VEBER_RULE>
0

$$$$
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3D-SDF for HMDB0006485 (10-Formyldihydrofolate)

HMDB0006485
     RDKit          3D
10-Formyldihydrofolate
 55 57  0  0  0  0  0  0  0  0999 V2000
    7.2963    3.6736    0.7812 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.3689    2.8132    0.1726 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3814    1.4962    0.4238 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.5077    0.6280   -0.1395 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5678    1.1240   -1.0073 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5433    2.4680   -1.2732 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6802    2.9125   -2.0677 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.4391    3.2724   -0.6799 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.6743    0.1970   -1.5831 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.6723   -1.0541   -1.3626 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6730   -1.9712   -2.0276 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8651   -2.6713   -1.0780 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.2387   -3.9298   -0.5528 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2907   -4.5257   -0.8697 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6442   -2.0828   -0.6453 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5792   -2.5019   -1.0602 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7060   -1.8605   -0.5762 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6299   -0.8022    0.3199 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7902   -0.1192    0.8440 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6139    0.9158    1.5536 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0948   -0.5700    0.5894 N   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2248    0.1555    1.1368 C   0  0  1  0  0  0  0  0  0  0  0  0
   -6.3165    0.4119    0.1633 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8865    1.2232   -1.0135 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4135    2.5423   -0.5572 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2565    2.8159   -0.1920 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3243    3.6135   -0.5173 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7373   -0.6774    2.2690 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2538   -1.7597    2.6189 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8469   -0.1843    2.9768 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3522   -0.3945    0.7276 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7488   -1.0342    0.2437 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6283   -1.6918   -0.4623 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5320   -0.7554    0.1394 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.2294    3.8124    0.3627 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.0469    4.1702    1.6503 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4311    4.3176   -0.8771 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0167   -1.3804   -2.7128 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2800   -2.6632   -2.6485 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5954   -4.4154    0.1588 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6529   -3.3330   -1.7638 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6758   -2.2208   -0.9314 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2441   -1.4351    0.0022 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8752    1.1046    1.5724 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8064   -0.5380   -0.1553 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.0867    1.0343    0.7045 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0840    0.7216   -1.5945 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7990    1.3826   -1.6594 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.2645    3.4659   -0.1280 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7548    0.3259    3.8460 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2921    0.4372    1.4326 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7390   -0.6924    0.5802 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0097   -2.1731    0.3647 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1900   -2.5252   -0.9621 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.2716   -1.0728    0.8339 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  2  0
  3  4  1  0
  4  5  2  0
  5  6  1  0
  6  7  2  0
  6  8  1  0
  5  9  1  0
  9 10  2  0
 10 11  1  0
 11 12  1  0
 12 13  1  0
 13 14  2  0
 12 15  1  0
 15 16  2  0
 16 17  1  0
 17 18  2  0
 18 19  1  0
 19 20  2  0
 19 21  1  0
 21 22  1  0
 22 23  1  0
 23 24  1  0
 24 25  1  0
 25 26  2  0
 25 27  1  0
 22 28  1  0
 28 29  2  0
 28 30  1  0
 18 31  1  0
 31 32  2  0
 10 33  1  0
 33 34  1  0
  8  2  1  0
 32 15  1  0
 34  4  1  0
  1 35  1  0
  1 36  1  0
  8 37  1  0
 11 38  1  0
 11 39  1  0
 13 40  1  0
 16 41  1  0
 17 42  1  0
 21 43  1  0
 22 44  1  1
 23 45  1  0
 23 46  1  0
 24 47  1  0
 24 48  1  0
 27 49  1  0
 30 50  1  0
 31 51  1  0
 32 52  1  0
 33 53  1  0
 33 54  1  0
 34 55  1  0
M  END
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PDB for HMDB0006485 (10-Formyldihydrofolate)

HEADER    PROTEIN                                 23-FEB-12   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   23-FEB-12         0                                  
HETATM    1  O   UNK     0      39.132 -15.666   0.000  0.00  0.00           O+0
HETATM    2  O   UNK     0      41.817 -20.276   0.000  0.00  0.00           O+0
HETATM    3  O   UNK     0      40.492 -22.591   0.000  0.00  0.00           O+0
HETATM    4  O   UNK     0      36.477 -18.756   0.000  0.00  0.00           O+0
HETATM    5  O   UNK     0      29.835 -25.712   0.000  0.00  0.00           O+0
HETATM    6  O   UNK     0      24.387 -21.129   0.000  0.00  0.00           O+0
HETATM    7  O   UNK     0      41.799 -15.656   0.000  0.00  0.00           O+0
HETATM    8  N   UNK     0      37.819 -21.061   0.000  0.00  0.00           N+0
HETATM    9  N   UNK     0      31.160 -23.397   0.000  0.00  0.00           N+0
HETATM   10  N   UNK     0      27.097 -22.616   0.000  0.00  0.00           N+0
HETATM   11  N   UNK     0      27.097 -25.803   0.000  0.00  0.00           N+0
HETATM   12  N   UNK     0      24.387 -25.749   0.000  0.00  0.00           N+0
HETATM   13  N   UNK     0      23.053 -23.439   0.000  0.00  0.00           N+0
HETATM   14  N   UNK     0      21.719 -25.749   0.000  0.00  0.00           N+0
HETATM   15  C   UNK     0      39.144 -18.746   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0      40.475 -17.971   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0      39.150 -20.286   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0      40.469 -16.431   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0      40.487 -21.051   0.000  0.00  0.00           C+0
HETATM   20  C   UNK     0      36.483 -20.296   0.000  0.00  0.00           C+0
HETATM   21  C   UNK     0      35.152 -21.071   0.000  0.00  0.00           C+0
HETATM   22  C   UNK     0      35.158 -22.611   0.000  0.00  0.00           C+0
HETATM   23  C   UNK     0      33.815 -20.307   0.000  0.00  0.00           C+0
HETATM   24  C   UNK     0      32.490 -22.622   0.000  0.00  0.00           C+0
HETATM   25  C   UNK     0      33.827 -23.387   0.000  0.00  0.00           C+0
HETATM   26  C   UNK     0      32.484 -21.082   0.000  0.00  0.00           C+0
HETATM   27  C   UNK     0      29.823 -22.632   0.000  0.00  0.00           C+0
HETATM   28  C   UNK     0      28.492 -23.407   0.000  0.00  0.00           C+0
HETATM   29  C   UNK     0      31.166 -24.937   0.000  0.00  0.00           C+0
HETATM   30  C   UNK     0      28.492 -25.011   0.000  0.00  0.00           C+0
HETATM   31  C   UNK     0      25.720 -23.439   0.000  0.00  0.00           C+0
HETATM   32  C   UNK     0      25.720 -24.979   0.000  0.00  0.00           C+0
HETATM   33  C   UNK     0      24.387 -22.669   0.000  0.00  0.00           C+0
HETATM   34  C   UNK     0      23.053 -24.979   0.000  0.00  0.00           C+0
CONECT    1   18                                                            
CONECT    2   19                                                            
CONECT    3   19                                                            
CONECT    4   20                                                            
CONECT    5   29                                                            
CONECT    6   33                                                            
CONECT    7   18                                                            
CONECT    8   17   20                                                       
CONECT    9   24   27   29                                                  
CONECT   10   28   31                                                       
CONECT   11   30   32                                                       
CONECT   12   32   34                                                       
CONECT   13   33   34                                                       
CONECT   14   34                                                            
CONECT   15   16   17                                                       
CONECT   16   15   18                                                       
CONECT   17    8   15   19                                                  
CONECT   18    1    7   16                                                  
CONECT   19    2    3   17                                                  
CONECT   20    4    8   21                                                  
CONECT   21   20   22   23                                                  
CONECT   22   21   25                                                       
CONECT   23   21   26                                                       
CONECT   24    9   25   26                                                  
CONECT   25   22   24                                                       
CONECT   26   23   24                                                       
CONECT   27    9   28                                                       
CONECT   28   10   27   30                                                  
CONECT   29    5    9                                                       
CONECT   30   11   28                                                       
CONECT   31   10   32   33                                                  
CONECT   32   11   12   31                                                  
CONECT   33    6   13   31                                                  
CONECT   34   12   13   14                                                  
MASTER        0    0    0    0    0    0    0    0   34    0   72    0
END
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3D PDB for HMDB0006485 (10-Formyldihydrofolate)

COMPND    HMDB0006485
HETATM    1  N1  UNL     1       7.296   3.674   0.781  1.00  0.00           N  
HETATM    2  C1  UNL     1       6.369   2.813   0.173  1.00  0.00           C  
HETATM    3  N2  UNL     1       6.381   1.496   0.424  1.00  0.00           N  
HETATM    4  C2  UNL     1       5.508   0.628  -0.140  1.00  0.00           C  
HETATM    5  C3  UNL     1       4.568   1.124  -1.007  1.00  0.00           C  
HETATM    6  C4  UNL     1       4.543   2.468  -1.273  1.00  0.00           C  
HETATM    7  O1  UNL     1       3.680   2.912  -2.068  1.00  0.00           O  
HETATM    8  N3  UNL     1       5.439   3.272  -0.680  1.00  0.00           N  
HETATM    9  N4  UNL     1       3.674   0.197  -1.583  1.00  0.00           N  
HETATM   10  C5  UNL     1       3.672  -1.054  -1.363  1.00  0.00           C  
HETATM   11  C6  UNL     1       2.673  -1.971  -2.028  1.00  0.00           C  
HETATM   12  N5  UNL     1       1.865  -2.671  -1.078  1.00  0.00           N  
HETATM   13  C7  UNL     1       2.239  -3.930  -0.553  1.00  0.00           C  
HETATM   14  O2  UNL     1       3.291  -4.526  -0.870  1.00  0.00           O  
HETATM   15  C8  UNL     1       0.644  -2.083  -0.645  1.00  0.00           C  
HETATM   16  C9  UNL     1      -0.579  -2.502  -1.060  1.00  0.00           C  
HETATM   17  C10 UNL     1      -1.706  -1.860  -0.576  1.00  0.00           C  
HETATM   18  C11 UNL     1      -1.630  -0.802   0.320  1.00  0.00           C  
HETATM   19  C12 UNL     1      -2.790  -0.119   0.844  1.00  0.00           C  
HETATM   20  O3  UNL     1      -2.614   0.916   1.554  1.00  0.00           O  
HETATM   21  N6  UNL     1      -4.095  -0.570   0.589  1.00  0.00           N  
HETATM   22  C13 UNL     1      -5.225   0.155   1.137  1.00  0.00           C  
HETATM   23  C14 UNL     1      -6.317   0.412   0.163  1.00  0.00           C  
HETATM   24  C15 UNL     1      -5.886   1.223  -1.014  1.00  0.00           C  
HETATM   25  C16 UNL     1      -5.413   2.542  -0.557  1.00  0.00           C  
HETATM   26  O4  UNL     1      -4.257   2.816  -0.192  1.00  0.00           O  
HETATM   27  O5  UNL     1      -6.324   3.613  -0.517  1.00  0.00           O  
HETATM   28  C17 UNL     1      -5.737  -0.677   2.269  1.00  0.00           C  
HETATM   29  O6  UNL     1      -5.254  -1.760   2.619  1.00  0.00           O  
HETATM   30  O7  UNL     1      -6.847  -0.184   2.977  1.00  0.00           O  
HETATM   31  C18 UNL     1      -0.352  -0.394   0.728  1.00  0.00           C  
HETATM   32  C19 UNL     1       0.749  -1.034   0.244  1.00  0.00           C  
HETATM   33  C20 UNL     1       4.628  -1.692  -0.462  1.00  0.00           C  
HETATM   34  N7  UNL     1       5.532  -0.755   0.139  1.00  0.00           N  
HETATM   35  H1  UNL     1       8.229   3.812   0.363  1.00  0.00           H  
HETATM   36  H2  UNL     1       7.047   4.170   1.650  1.00  0.00           H  
HETATM   37  H3  UNL     1       5.431   4.318  -0.877  1.00  0.00           H  
HETATM   38  H4  UNL     1       2.017  -1.380  -2.713  1.00  0.00           H  
HETATM   39  H5  UNL     1       3.280  -2.663  -2.649  1.00  0.00           H  
HETATM   40  H6  UNL     1       1.595  -4.415   0.159  1.00  0.00           H  
HETATM   41  H7  UNL     1      -0.653  -3.333  -1.764  1.00  0.00           H  
HETATM   42  H8  UNL     1      -2.676  -2.221  -0.931  1.00  0.00           H  
HETATM   43  H9  UNL     1      -4.244  -1.435   0.002  1.00  0.00           H  
HETATM   44  H10 UNL     1      -4.875   1.105   1.572  1.00  0.00           H  
HETATM   45  H11 UNL     1      -6.806  -0.538  -0.155  1.00  0.00           H  
HETATM   46  H12 UNL     1      -7.087   1.034   0.705  1.00  0.00           H  
HETATM   47  H13 UNL     1      -5.084   0.722  -1.594  1.00  0.00           H  
HETATM   48  H14 UNL     1      -6.799   1.383  -1.659  1.00  0.00           H  
HETATM   49  H15 UNL     1      -7.265   3.466  -0.128  1.00  0.00           H  
HETATM   50  H16 UNL     1      -6.755   0.326   3.846  1.00  0.00           H  
HETATM   51  H17 UNL     1      -0.292   0.437   1.433  1.00  0.00           H  
HETATM   52  H18 UNL     1       1.739  -0.692   0.580  1.00  0.00           H  
HETATM   53  H19 UNL     1       4.010  -2.173   0.365  1.00  0.00           H  
HETATM   54  H20 UNL     1       5.190  -2.525  -0.962  1.00  0.00           H  
HETATM   55  H21 UNL     1       6.272  -1.073   0.834  1.00  0.00           H  
CONECT    1    2   35   36
CONECT    2    3    3    8
CONECT    3    4
CONECT    4    5    5   34
CONECT    5    6    9
CONECT    6    7    7    8
CONECT    8   37
CONECT    9   10   10
CONECT   10   11   33
CONECT   11   12   38   39
CONECT   12   13   15
CONECT   13   14   14   40
CONECT   15   16   16   32
CONECT   16   17   41
CONECT   17   18   18   42
CONECT   18   19   31
CONECT   19   20   20   21
CONECT   21   22   43
CONECT   22   23   28   44
CONECT   23   24   45   46
CONECT   24   25   47   48
CONECT   25   26   26   27
CONECT   27   49
CONECT   28   29   29   30
CONECT   30   50
CONECT   31   32   32   51
CONECT   32   52
CONECT   33   34   53   54
CONECT   34   55
END
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SMILES for HMDB0006485 (10-Formyldihydrofolate)

NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C=C3)C(=O)N[C@@H](CCC(O)=O)C(O)=O)CN2)C(=O)N1
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INCHI for HMDB0006485 (10-Formyldihydrofolate)

InChI=1S/C20H21N7O7/c21-20-25-16-15(18(32)26-20)23-11(7-22-16)8-27(9-28)12-3-1-10(2-4-12)17(31)24-13(19(33)34)5-6-14(29)30/h1-4,9,13H,5-8H2,(H,24,31)(H,29,30)(H,33,34)(H4,21,22,25,26,32)/t13-/m0/s1
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View in JSmolView NMR AssignmentsView Stereo Labels
Synonyms
ValueSource
10-Formyl-7,8-dihydrofolateChEBI
N-(10-Formyl-7,8-dihydropteroyl)-L-glutamateChEBI
10-Formyl-7,8-dihydrofolic acidGenerator
N-(10-Formyl-7,8-dihydropteroyl)-L-glutamic acidGenerator
10-Formyldihydrofolic acidGenerator
10-FormyldihydropteroylglutamateHMDB
10-FormyldihydrofolateChEBI
Chemical FormulaC20H21N7O7
Average Molecular Weight471.4234
Monoisotopic Molecular Weight471.150246061
IUPAC Name(2S)-2-[(4-{N-[(2-amino-4-oxo-3,4,7,8-tetrahydropteridin-6-yl)methyl]formamido}phenyl)formamido]pentanedioic acid
Traditional Name10-formyldihydrofolic acid
CAS Registry NumberNot Available
SMILES
NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C=C3)C(=O)N[C@@H](CCC(O)=O)C(O)=O)CN2)C(=O)N1
InChI Identifier
InChI=1S/C20H21N7O7/c21-20-25-16-15(18(32)26-20)23-11(7-22-16)8-27(9-28)12-3-1-10(2-4-12)17(31)24-13(19(33)34)5-6-14(29)30/h1-4,9,13H,5-8H2,(H,24,31)(H,29,30)(H,33,34)(H4,21,22,25,26,32)/t13-/m0/s1
InChI KeyUXFQDXABPXWSTK-ZDUSSCGKSA-N
Chemical Taxonomy
Description Belongs to the class of organic compounds known as dihydrofolic acids and derivatives. These are heterocyclic compounds based on the 5,6-dihydropteroic acid/7,8-dihydropteroic acid skeleton conjugated with one or more L-glutamic acid units (or derivative thereof).
KingdomOrganic compounds
Super ClassOrganoheterocyclic compounds
ClassPteridines and derivatives
Sub ClassPterins and derivatives
Direct ParentDihydrofolic acids and derivatives
Alternative Parents
Substituents
  • Dihydrofolic acid or derivatives
  • Glutamic acid or derivatives
  • N-acyl-alpha-amino acid
  • Acylaminobenzoic acid or derivatives
  • N-acyl-alpha amino acid or derivatives
  • Hippuric acid
  • Hippuric acid or derivatives
  • Alpha-amino acid or derivatives
  • Benzamide
  • Benzoic acid or derivatives
  • Anilide
  • Benzoyl
  • Aminopyrimidine
  • Pyrimidone
  • Secondary aliphatic/aromatic amine
  • Monocyclic benzene moiety
  • Pyrimidine
  • Benzenoid
  • Dicarboxylic acid or derivatives
  • Vinylogous amide
  • Heteroaromatic compound
  • Tertiary carboxylic acid amide
  • Carboxamide group
  • Amino acid or derivatives
  • Amino acid
  • Ketimine
  • Secondary carboxylic acid amide
  • Azacycle
  • Organic 1,3-dipolar compound
  • Propargyl-type 1,3-dipolar organic compound
  • Carboxylic acid derivative
  • Carboxylic acid
  • Secondary amine
  • Organopnictogen compound
  • Organic oxygen compound
  • Carbonyl group
  • Amine
  • Organic nitrogen compound
  • Hydrocarbon derivative
  • Organic oxide
  • Primary amine
  • Organooxygen compound
  • Organonitrogen compound
  • Imine
  • Aromatic heteropolycyclic compound
Molecular FrameworkAromatic heteropolycyclic compounds
External Descriptors
Ontology
Physiological effectNot Available
Disposition
Biological locationSource
ProcessNot Available
RoleNot Available
Physical Properties
StateSolid
Experimental Molecular Properties
PropertyValueReference
Melting PointNot AvailableNot Available
Boiling PointNot AvailableNot Available
Water SolubilityNot AvailableNot Available
LogPNot AvailableNot Available
Experimental Chromatographic PropertiesNot Available
Predicted Molecular Properties
PropertyValueSource
Water Solubility0.1 g/LALOGPS
logP-1.3ALOGPS
logP-2.4ChemAxon
logS-3.7ALOGPS
pKa (Strongest Acidic)2.96ChemAxon
pKa (Strongest Basic)3.51ChemAxon
Physiological Charge-2ChemAxon
Hydrogen Acceptor Count11ChemAxon
Hydrogen Donor Count6ChemAxon
Polar Surface Area215.88 ŲChemAxon
Rotatable Bond Count9ChemAxon
Refractivity124.49 m³·mol⁻¹ChemAxon
Polarizability44.82 ųChemAxon
Number of Rings3ChemAxon
BioavailabilityNoChemAxon
Rule of FiveNoChemAxon
Ghose FilterNoChemAxon
Veber's RuleNoChemAxon
MDDR-like RuleYesChemAxon
Predicted Chromatographic Properties

Predicted Collision Cross Sections

PredictorAdduct TypeCCS Value (Å2)Reference
DarkChem[M+H]+208.66731661259
DarkChem[M-H]-201.90831661259
DeepCCS[M+H]+205.89530932474
DeepCCS[M-H]-203.530932474
DeepCCS[M-2H]-236.38430932474
DeepCCS[M+Na]+211.80830932474
AllCCS[M+H]+201.732859911
AllCCS[M+H-H2O]+199.932859911
AllCCS[M+NH4]+203.332859911
AllCCS[M+Na]+203.832859911
AllCCS[M-H]-200.232859911
AllCCS[M+Na-2H]-200.832859911
AllCCS[M+HCOO]-201.632859911

Predicted Kovats Retention Indices

Underivatized

MetaboliteSMILESKovats RI ValueColumn TypeReference
10-FormyldihydrofolateNC1=NC2=C(N=C(CN(C=O)C3=CC=C(C=C3)C(=O)N[C@@H](CCC(O)=O)C(O)=O)CN2)C(=O)N15186.8Standard polar33892256
10-FormyldihydrofolateNC1=NC2=C(N=C(CN(C=O)C3=CC=C(C=C3)C(=O)N[C@@H](CCC(O)=O)C(O)=O)CN2)C(=O)N13926.6Standard non polar33892256
10-FormyldihydrofolateNC1=NC2=C(N=C(CN(C=O)C3=CC=C(C=C3)C(=O)N[C@@H](CCC(O)=O)C(O)=O)CN2)C(=O)N15340.4Semi standard non polar33892256

Derivatized

Derivative Name / StructureSMILESKovats RI ValueColumn TypeReference
10-Formyldihydrofolate,1TMS,isomer #1C[Si](C)(C)OC(=O)CC[C@H](NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)[NH]C3=O)NC2)C=C1)C(=O)O4733.3Semi standard non polar33892256
10-Formyldihydrofolate,1TMS,isomer #2C[Si](C)(C)OC(=O)[C@H](CCC(=O)O)NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)[NH]C3=O)NC2)C=C14711.8Semi standard non polar33892256
10-Formyldihydrofolate,1TMS,isomer #3C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N[C@@H](CCC(=O)O)C(=O)O)C=C3)CN2)C(=O)[NH]14905.4Semi standard non polar33892256
10-Formyldihydrofolate,1TMS,isomer #4C[Si](C)(C)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)[NH]C3=O)NC2)C=C1)[C@@H](CCC(=O)O)C(=O)O4710.9Semi standard non polar33892256
10-Formyldihydrofolate,1TMS,isomer #5C[Si](C)(C)N1CC(CN(C=O)C2=CC=C(C(=O)N[C@@H](CCC(=O)O)C(=O)O)C=C2)=NC2=C1N=C(N)[NH]C2=O4626.9Semi standard non polar33892256
10-Formyldihydrofolate,1TMS,isomer #6C[Si](C)(C)N1C(N)=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N[C@@H](CCC(=O)O)C(=O)O)C=C3)CN2)C1=O4779.8Semi standard non polar33892256
10-Formyldihydrofolate,2TMS,isomer #1C[Si](C)(C)OC(=O)CC[C@H](NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)[NH]C3=O)NC2)C=C1)C(=O)O[Si](C)(C)C4525.0Semi standard non polar33892256
10-Formyldihydrofolate,2TMS,isomer #10C[Si](C)(C)N(C1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N[C@@H](CCC(=O)O)C(=O)O)C=C3)CN2)C(=O)[NH]1)[Si](C)(C)C4712.7Semi standard non polar33892256
10-Formyldihydrofolate,2TMS,isomer #11C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N[C@@H](CCC(=O)O)C(=O)O)C=C3)CN2)C(=O)N1[Si](C)(C)C4793.5Semi standard non polar33892256
10-Formyldihydrofolate,2TMS,isomer #12C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N([C@@H](CCC(=O)O)C(=O)O)[Si](C)(C)C)C=C3)CN2)C(=O)[NH]14665.1Semi standard non polar33892256
10-Formyldihydrofolate,2TMS,isomer #13C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N[C@@H](CCC(=O)O)C(=O)O)C=C3)CN2[Si](C)(C)C)C(=O)[NH]14605.2Semi standard non polar33892256
10-Formyldihydrofolate,2TMS,isomer #14C[Si](C)(C)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)N([Si](C)(C)C)C3=O)NC2)C=C1)[C@@H](CCC(=O)O)C(=O)O4575.8Semi standard non polar33892256
10-Formyldihydrofolate,2TMS,isomer #15C[Si](C)(C)N1CC(CN(C=O)C2=CC=C(C(=O)N([C@@H](CCC(=O)O)C(=O)O)[Si](C)(C)C)C=C2)=NC2=C1N=C(N)[NH]C2=O4358.8Semi standard non polar33892256
10-Formyldihydrofolate,2TMS,isomer #16C[Si](C)(C)N1CC(CN(C=O)C2=CC=C(C(=O)N[C@@H](CCC(=O)O)C(=O)O)C=C2)=NC2=C1N=C(N)N([Si](C)(C)C)C2=O4568.0Semi standard non polar33892256
10-Formyldihydrofolate,2TMS,isomer #2C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N[C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O)C=C3)CN2)C(=O)[NH]14663.9Semi standard non polar33892256
10-Formyldihydrofolate,2TMS,isomer #3C[Si](C)(C)OC(=O)CC[C@@H](C(=O)O)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)[NH]C3=O)NC2)C=C1)[Si](C)(C)C4474.3Semi standard non polar33892256
10-Formyldihydrofolate,2TMS,isomer #4C[Si](C)(C)OC(=O)CC[C@H](NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)N([Si](C)(C)C)C3=O)NC2)C=C1)C(=O)O4598.8Semi standard non polar33892256
10-Formyldihydrofolate,2TMS,isomer #5C[Si](C)(C)OC(=O)CC[C@H](NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)[NH]C3=O)N([Si](C)(C)C)C2)C=C1)C(=O)O4384.7Semi standard non polar33892256
10-Formyldihydrofolate,2TMS,isomer #6C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N[C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C)C=C3)CN2)C(=O)[NH]14666.7Semi standard non polar33892256
10-Formyldihydrofolate,2TMS,isomer #7C[Si](C)(C)OC(=O)[C@H](CCC(=O)O)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)[NH]C3=O)NC2)C=C1)[Si](C)(C)C4501.7Semi standard non polar33892256
10-Formyldihydrofolate,2TMS,isomer #8C[Si](C)(C)OC(=O)[C@H](CCC(=O)O)NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)N([Si](C)(C)C)C3=O)NC2)C=C14584.8Semi standard non polar33892256
10-Formyldihydrofolate,2TMS,isomer #9C[Si](C)(C)OC(=O)[C@H](CCC(=O)O)NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)[NH]C3=O)N([Si](C)(C)C)C2)C=C14376.4Semi standard non polar33892256
10-Formyldihydrofolate,3TMS,isomer #1C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N[C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C)C=C3)CN2)C(=O)[NH]14506.7Semi standard non polar33892256
10-Formyldihydrofolate,3TMS,isomer #1C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N[C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C)C=C3)CN2)C(=O)[NH]14262.0Standard non polar33892256
10-Formyldihydrofolate,3TMS,isomer #1C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N[C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C)C=C3)CN2)C(=O)[NH]17607.1Standard polar33892256
10-Formyldihydrofolate,3TMS,isomer #10C[Si](C)(C)OC(=O)CC[C@@H](C(=O)O)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)[NH]C3=O)N([Si](C)(C)C)C2)C=C1)[Si](C)(C)C4189.1Semi standard non polar33892256
10-Formyldihydrofolate,3TMS,isomer #10C[Si](C)(C)OC(=O)CC[C@@H](C(=O)O)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)[NH]C3=O)N([Si](C)(C)C)C2)C=C1)[Si](C)(C)C4151.1Standard non polar33892256
10-Formyldihydrofolate,3TMS,isomer #10C[Si](C)(C)OC(=O)CC[C@@H](C(=O)O)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)[NH]C3=O)N([Si](C)(C)C)C2)C=C1)[Si](C)(C)C6810.9Standard polar33892256
10-Formyldihydrofolate,3TMS,isomer #11C[Si](C)(C)OC(=O)CC[C@H](NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)N([Si](C)(C)C)C3=O)N([Si](C)(C)C)C2)C=C1)C(=O)O4382.7Semi standard non polar33892256
10-Formyldihydrofolate,3TMS,isomer #11C[Si](C)(C)OC(=O)CC[C@H](NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)N([Si](C)(C)C)C3=O)N([Si](C)(C)C)C2)C=C1)C(=O)O4192.2Standard non polar33892256
10-Formyldihydrofolate,3TMS,isomer #11C[Si](C)(C)OC(=O)CC[C@H](NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)N([Si](C)(C)C)C3=O)N([Si](C)(C)C)C2)C=C1)C(=O)O6966.8Standard polar33892256
10-Formyldihydrofolate,3TMS,isomer #12C[Si](C)(C)OC(=O)[C@H](CCC(=O)O)NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N([Si](C)(C)C)[Si](C)(C)C)[NH]C3=O)NC2)C=C14513.4Semi standard non polar33892256
10-Formyldihydrofolate,3TMS,isomer #12C[Si](C)(C)OC(=O)[C@H](CCC(=O)O)NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N([Si](C)(C)C)[Si](C)(C)C)[NH]C3=O)NC2)C=C14262.8Standard non polar33892256
10-Formyldihydrofolate,3TMS,isomer #12C[Si](C)(C)OC(=O)[C@H](CCC(=O)O)NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N([Si](C)(C)C)[Si](C)(C)C)[NH]C3=O)NC2)C=C17260.8Standard polar33892256
10-Formyldihydrofolate,3TMS,isomer #13C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N[C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C)C=C3)CN2)C(=O)N1[Si](C)(C)C4603.5Semi standard non polar33892256
10-Formyldihydrofolate,3TMS,isomer #13C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N[C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C)C=C3)CN2)C(=O)N1[Si](C)(C)C4232.2Standard non polar33892256
10-Formyldihydrofolate,3TMS,isomer #13C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N[C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C)C=C3)CN2)C(=O)N1[Si](C)(C)C7322.5Standard polar33892256
10-Formyldihydrofolate,3TMS,isomer #14C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N([C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C=C3)CN2)C(=O)[NH]14467.6Semi standard non polar33892256
10-Formyldihydrofolate,3TMS,isomer #14C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N([C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C=C3)CN2)C(=O)[NH]14163.2Standard non polar33892256
10-Formyldihydrofolate,3TMS,isomer #14C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N([C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C=C3)CN2)C(=O)[NH]17532.8Standard polar33892256
10-Formyldihydrofolate,3TMS,isomer #15C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N[C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C)C=C3)CN2[Si](C)(C)C)C(=O)[NH]14408.3Semi standard non polar33892256
10-Formyldihydrofolate,3TMS,isomer #15C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N[C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C)C=C3)CN2[Si](C)(C)C)C(=O)[NH]14255.6Standard non polar33892256
10-Formyldihydrofolate,3TMS,isomer #15C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N[C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C)C=C3)CN2[Si](C)(C)C)C(=O)[NH]17137.1Standard polar33892256
10-Formyldihydrofolate,3TMS,isomer #16C[Si](C)(C)OC(=O)[C@H](CCC(=O)O)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)N([Si](C)(C)C)C3=O)NC2)C=C1)[Si](C)(C)C4398.9Semi standard non polar33892256
10-Formyldihydrofolate,3TMS,isomer #16C[Si](C)(C)OC(=O)[C@H](CCC(=O)O)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)N([Si](C)(C)C)C3=O)NC2)C=C1)[Si](C)(C)C4026.0Standard non polar33892256
10-Formyldihydrofolate,3TMS,isomer #16C[Si](C)(C)OC(=O)[C@H](CCC(=O)O)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)N([Si](C)(C)C)C3=O)NC2)C=C1)[Si](C)(C)C7014.6Standard polar33892256
10-Formyldihydrofolate,3TMS,isomer #17C[Si](C)(C)OC(=O)[C@H](CCC(=O)O)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)[NH]C3=O)N([Si](C)(C)C)C2)C=C1)[Si](C)(C)C4202.3Semi standard non polar33892256
10-Formyldihydrofolate,3TMS,isomer #17C[Si](C)(C)OC(=O)[C@H](CCC(=O)O)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)[NH]C3=O)N([Si](C)(C)C)C2)C=C1)[Si](C)(C)C4107.8Standard non polar33892256
10-Formyldihydrofolate,3TMS,isomer #17C[Si](C)(C)OC(=O)[C@H](CCC(=O)O)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)[NH]C3=O)N([Si](C)(C)C)C2)C=C1)[Si](C)(C)C6764.7Standard polar33892256
10-Formyldihydrofolate,3TMS,isomer #18C[Si](C)(C)OC(=O)[C@H](CCC(=O)O)NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)N([Si](C)(C)C)C3=O)N([Si](C)(C)C)C2)C=C14369.8Semi standard non polar33892256
10-Formyldihydrofolate,3TMS,isomer #18C[Si](C)(C)OC(=O)[C@H](CCC(=O)O)NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)N([Si](C)(C)C)C3=O)N([Si](C)(C)C)C2)C=C14146.5Standard non polar33892256
10-Formyldihydrofolate,3TMS,isomer #18C[Si](C)(C)OC(=O)[C@H](CCC(=O)O)NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)N([Si](C)(C)C)C3=O)N([Si](C)(C)C)C2)C=C16889.4Standard polar33892256
10-Formyldihydrofolate,3TMS,isomer #19C[Si](C)(C)N(C1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N[C@@H](CCC(=O)O)C(=O)O)C=C3)CN2)C(=O)N1[Si](C)(C)C)[Si](C)(C)C4694.7Semi standard non polar33892256
10-Formyldihydrofolate,3TMS,isomer #19C[Si](C)(C)N(C1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N[C@@H](CCC(=O)O)C(=O)O)C=C3)CN2)C(=O)N1[Si](C)(C)C)[Si](C)(C)C4345.2Standard non polar33892256
10-Formyldihydrofolate,3TMS,isomer #19C[Si](C)(C)N(C1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N[C@@H](CCC(=O)O)C(=O)O)C=C3)CN2)C(=O)N1[Si](C)(C)C)[Si](C)(C)C7311.7Standard polar33892256
10-Formyldihydrofolate,3TMS,isomer #2C[Si](C)(C)OC(=O)CC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)[NH]C3=O)NC2)C=C1)[Si](C)(C)C4349.5Semi standard non polar33892256
10-Formyldihydrofolate,3TMS,isomer #2C[Si](C)(C)OC(=O)CC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)[NH]C3=O)NC2)C=C1)[Si](C)(C)C4046.4Standard non polar33892256
10-Formyldihydrofolate,3TMS,isomer #2C[Si](C)(C)OC(=O)CC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)[NH]C3=O)NC2)C=C1)[Si](C)(C)C6958.6Standard polar33892256
10-Formyldihydrofolate,3TMS,isomer #20C[Si](C)(C)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N([Si](C)(C)C)[Si](C)(C)C)[NH]C3=O)NC2)C=C1)[C@@H](CCC(=O)O)C(=O)O4486.3Semi standard non polar33892256
10-Formyldihydrofolate,3TMS,isomer #20C[Si](C)(C)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N([Si](C)(C)C)[Si](C)(C)C)[NH]C3=O)NC2)C=C1)[C@@H](CCC(=O)O)C(=O)O4223.0Standard non polar33892256
10-Formyldihydrofolate,3TMS,isomer #20C[Si](C)(C)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N([Si](C)(C)C)[Si](C)(C)C)[NH]C3=O)NC2)C=C1)[C@@H](CCC(=O)O)C(=O)O7256.9Standard polar33892256
10-Formyldihydrofolate,3TMS,isomer #21C[Si](C)(C)N1CC(CN(C=O)C2=CC=C(C(=O)N[C@@H](CCC(=O)O)C(=O)O)C=C2)=NC2=C1N=C(N([Si](C)(C)C)[Si](C)(C)C)[NH]C2=O4454.7Semi standard non polar33892256
10-Formyldihydrofolate,3TMS,isomer #21C[Si](C)(C)N1CC(CN(C=O)C2=CC=C(C(=O)N[C@@H](CCC(=O)O)C(=O)O)C=C2)=NC2=C1N=C(N([Si](C)(C)C)[Si](C)(C)C)[NH]C2=O4339.7Standard non polar33892256
10-Formyldihydrofolate,3TMS,isomer #21C[Si](C)(C)N1CC(CN(C=O)C2=CC=C(C(=O)N[C@@H](CCC(=O)O)C(=O)O)C=C2)=NC2=C1N=C(N([Si](C)(C)C)[Si](C)(C)C)[NH]C2=O7036.9Standard polar33892256
10-Formyldihydrofolate,3TMS,isomer #22C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N([C@@H](CCC(=O)O)C(=O)O)[Si](C)(C)C)C=C3)CN2)C(=O)N1[Si](C)(C)C4580.5Semi standard non polar33892256
10-Formyldihydrofolate,3TMS,isomer #22C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N([C@@H](CCC(=O)O)C(=O)O)[Si](C)(C)C)C=C3)CN2)C(=O)N1[Si](C)(C)C4196.9Standard non polar33892256
10-Formyldihydrofolate,3TMS,isomer #22C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N([C@@H](CCC(=O)O)C(=O)O)[Si](C)(C)C)C=C3)CN2)C(=O)N1[Si](C)(C)C7302.8Standard polar33892256
10-Formyldihydrofolate,3TMS,isomer #23C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N[C@@H](CCC(=O)O)C(=O)O)C=C3)CN2[Si](C)(C)C)C(=O)N1[Si](C)(C)C4565.8Semi standard non polar33892256
10-Formyldihydrofolate,3TMS,isomer #23C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N[C@@H](CCC(=O)O)C(=O)O)C=C3)CN2[Si](C)(C)C)C(=O)N1[Si](C)(C)C4329.6Standard non polar33892256
10-Formyldihydrofolate,3TMS,isomer #23C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N[C@@H](CCC(=O)O)C(=O)O)C=C3)CN2[Si](C)(C)C)C(=O)N1[Si](C)(C)C6922.1Standard polar33892256
10-Formyldihydrofolate,3TMS,isomer #24C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N([C@@H](CCC(=O)O)C(=O)O)[Si](C)(C)C)C=C3)CN2[Si](C)(C)C)C(=O)[NH]14380.9Semi standard non polar33892256
10-Formyldihydrofolate,3TMS,isomer #24C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N([C@@H](CCC(=O)O)C(=O)O)[Si](C)(C)C)C=C3)CN2[Si](C)(C)C)C(=O)[NH]14241.0Standard non polar33892256
10-Formyldihydrofolate,3TMS,isomer #24C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N([C@@H](CCC(=O)O)C(=O)O)[Si](C)(C)C)C=C3)CN2[Si](C)(C)C)C(=O)[NH]17125.5Standard polar33892256
10-Formyldihydrofolate,3TMS,isomer #25C[Si](C)(C)N1CC(CN(C=O)C2=CC=C(C(=O)N([C@@H](CCC(=O)O)C(=O)O)[Si](C)(C)C)C=C2)=NC2=C1N=C(N)N([Si](C)(C)C)C2=O4329.0Semi standard non polar33892256
10-Formyldihydrofolate,3TMS,isomer #25C[Si](C)(C)N1CC(CN(C=O)C2=CC=C(C(=O)N([C@@H](CCC(=O)O)C(=O)O)[Si](C)(C)C)C=C2)=NC2=C1N=C(N)N([Si](C)(C)C)C2=O4131.6Standard non polar33892256
10-Formyldihydrofolate,3TMS,isomer #25C[Si](C)(C)N1CC(CN(C=O)C2=CC=C(C(=O)N([C@@H](CCC(=O)O)C(=O)O)[Si](C)(C)C)C=C2)=NC2=C1N=C(N)N([Si](C)(C)C)C2=O6886.2Standard polar33892256
10-Formyldihydrofolate,3TMS,isomer #3C[Si](C)(C)OC(=O)CC[C@H](NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)N([Si](C)(C)C)C3=O)NC2)C=C1)C(=O)O[Si](C)(C)C4434.3Semi standard non polar33892256
10-Formyldihydrofolate,3TMS,isomer #3C[Si](C)(C)OC(=O)CC[C@H](NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)N([Si](C)(C)C)C3=O)NC2)C=C1)C(=O)O[Si](C)(C)C4097.4Standard non polar33892256
10-Formyldihydrofolate,3TMS,isomer #3C[Si](C)(C)OC(=O)CC[C@H](NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)N([Si](C)(C)C)C3=O)NC2)C=C1)C(=O)O[Si](C)(C)C7079.2Standard polar33892256
10-Formyldihydrofolate,3TMS,isomer #4C[Si](C)(C)OC(=O)CC[C@H](NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)[NH]C3=O)N([Si](C)(C)C)C2)C=C1)C(=O)O[Si](C)(C)C4228.4Semi standard non polar33892256
10-Formyldihydrofolate,3TMS,isomer #4C[Si](C)(C)OC(=O)CC[C@H](NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)[NH]C3=O)N([Si](C)(C)C)C2)C=C1)C(=O)O[Si](C)(C)C4157.2Standard non polar33892256
10-Formyldihydrofolate,3TMS,isomer #4C[Si](C)(C)OC(=O)CC[C@H](NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)[NH]C3=O)N([Si](C)(C)C)C2)C=C1)C(=O)O[Si](C)(C)C6835.6Standard polar33892256
10-Formyldihydrofolate,3TMS,isomer #5C[Si](C)(C)OC(=O)CC[C@H](NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N([Si](C)(C)C)[Si](C)(C)C)[NH]C3=O)NC2)C=C1)C(=O)O4509.9Semi standard non polar33892256
10-Formyldihydrofolate,3TMS,isomer #5C[Si](C)(C)OC(=O)CC[C@H](NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N([Si](C)(C)C)[Si](C)(C)C)[NH]C3=O)NC2)C=C1)C(=O)O4342.1Standard non polar33892256
10-Formyldihydrofolate,3TMS,isomer #5C[Si](C)(C)OC(=O)CC[C@H](NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N([Si](C)(C)C)[Si](C)(C)C)[NH]C3=O)NC2)C=C1)C(=O)O7344.2Standard polar33892256
10-Formyldihydrofolate,3TMS,isomer #6C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N[C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O)C=C3)CN2)C(=O)N1[Si](C)(C)C4610.6Semi standard non polar33892256
10-Formyldihydrofolate,3TMS,isomer #6C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N[C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O)C=C3)CN2)C(=O)N1[Si](C)(C)C4313.0Standard non polar33892256
10-Formyldihydrofolate,3TMS,isomer #6C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N[C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O)C=C3)CN2)C(=O)N1[Si](C)(C)C7402.7Standard polar33892256
10-Formyldihydrofolate,3TMS,isomer #7C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N([C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O)[Si](C)(C)C)C=C3)CN2)C(=O)[NH]14447.1Semi standard non polar33892256
10-Formyldihydrofolate,3TMS,isomer #7C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N([C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O)[Si](C)(C)C)C=C3)CN2)C(=O)[NH]14209.8Standard non polar33892256
10-Formyldihydrofolate,3TMS,isomer #7C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N([C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O)[Si](C)(C)C)C=C3)CN2)C(=O)[NH]17582.5Standard polar33892256
10-Formyldihydrofolate,3TMS,isomer #8C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N[C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O)C=C3)CN2[Si](C)(C)C)C(=O)[NH]14412.1Semi standard non polar33892256
10-Formyldihydrofolate,3TMS,isomer #8C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N[C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O)C=C3)CN2[Si](C)(C)C)C(=O)[NH]14314.2Standard non polar33892256
10-Formyldihydrofolate,3TMS,isomer #8C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N[C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O)C=C3)CN2[Si](C)(C)C)C(=O)[NH]17212.3Standard polar33892256
10-Formyldihydrofolate,3TMS,isomer #9C[Si](C)(C)OC(=O)CC[C@@H](C(=O)O)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)N([Si](C)(C)C)C3=O)NC2)C=C1)[Si](C)(C)C4388.8Semi standard non polar33892256
10-Formyldihydrofolate,3TMS,isomer #9C[Si](C)(C)OC(=O)CC[C@@H](C(=O)O)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)N([Si](C)(C)C)C3=O)NC2)C=C1)[Si](C)(C)C4066.8Standard non polar33892256
10-Formyldihydrofolate,3TMS,isomer #9C[Si](C)(C)OC(=O)CC[C@@H](C(=O)O)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)N([Si](C)(C)C)C3=O)NC2)C=C1)[Si](C)(C)C7063.5Standard polar33892256
10-Formyldihydrofolate,4TMS,isomer #1C[Si](C)(C)OC(=O)CC[C@H](NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N([Si](C)(C)C)[Si](C)(C)C)[NH]C3=O)NC2)C=C1)C(=O)O[Si](C)(C)C4389.9Semi standard non polar33892256
10-Formyldihydrofolate,4TMS,isomer #1C[Si](C)(C)OC(=O)CC[C@H](NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N([Si](C)(C)C)[Si](C)(C)C)[NH]C3=O)NC2)C=C1)C(=O)O[Si](C)(C)C4282.8Standard non polar33892256
10-Formyldihydrofolate,4TMS,isomer #1C[Si](C)(C)OC(=O)CC[C@H](NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N([Si](C)(C)C)[Si](C)(C)C)[NH]C3=O)NC2)C=C1)C(=O)O[Si](C)(C)C6888.6Standard polar33892256
10-Formyldihydrofolate,4TMS,isomer #10C[Si](C)(C)OC(=O)CC[C@H](NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N([Si](C)(C)C)[Si](C)(C)C)[NH]C3=O)N([Si](C)(C)C)C2)C=C1)C(=O)O4345.8Semi standard non polar33892256
10-Formyldihydrofolate,4TMS,isomer #10C[Si](C)(C)OC(=O)CC[C@H](NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N([Si](C)(C)C)[Si](C)(C)C)[NH]C3=O)N([Si](C)(C)C)C2)C=C1)C(=O)O4342.9Standard non polar33892256
10-Formyldihydrofolate,4TMS,isomer #10C[Si](C)(C)OC(=O)CC[C@H](NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N([Si](C)(C)C)[Si](C)(C)C)[NH]C3=O)N([Si](C)(C)C)C2)C=C1)C(=O)O6686.8Standard polar33892256
10-Formyldihydrofolate,4TMS,isomer #11C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N([C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O)[Si](C)(C)C)C=C3)CN2)C(=O)N1[Si](C)(C)C4429.8Semi standard non polar33892256
10-Formyldihydrofolate,4TMS,isomer #11C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N([C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O)[Si](C)(C)C)C=C3)CN2)C(=O)N1[Si](C)(C)C4186.8Standard non polar33892256
10-Formyldihydrofolate,4TMS,isomer #11C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N([C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O)[Si](C)(C)C)C=C3)CN2)C(=O)N1[Si](C)(C)C6942.9Standard polar33892256
10-Formyldihydrofolate,4TMS,isomer #12C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N[C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O)C=C3)CN2[Si](C)(C)C)C(=O)N1[Si](C)(C)C4422.3Semi standard non polar33892256
10-Formyldihydrofolate,4TMS,isomer #12C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N[C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O)C=C3)CN2[Si](C)(C)C)C(=O)N1[Si](C)(C)C4279.2Standard non polar33892256
10-Formyldihydrofolate,4TMS,isomer #12C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N[C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O)C=C3)CN2[Si](C)(C)C)C(=O)N1[Si](C)(C)C6582.3Standard polar33892256
10-Formyldihydrofolate,4TMS,isomer #13C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N([C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O)[Si](C)(C)C)C=C3)CN2[Si](C)(C)C)C(=O)[NH]14248.7Semi standard non polar33892256
10-Formyldihydrofolate,4TMS,isomer #13C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N([C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O)[Si](C)(C)C)C=C3)CN2[Si](C)(C)C)C(=O)[NH]14228.4Standard non polar33892256
10-Formyldihydrofolate,4TMS,isomer #13C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N([C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O)[Si](C)(C)C)C=C3)CN2[Si](C)(C)C)C(=O)[NH]16783.0Standard polar33892256
10-Formyldihydrofolate,4TMS,isomer #14C[Si](C)(C)OC(=O)CC[C@@H](C(=O)O)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)N([Si](C)(C)C)C3=O)N([Si](C)(C)C)C2)C=C1)[Si](C)(C)C4216.9Semi standard non polar33892256
10-Formyldihydrofolate,4TMS,isomer #14C[Si](C)(C)OC(=O)CC[C@@H](C(=O)O)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)N([Si](C)(C)C)C3=O)N([Si](C)(C)C)C2)C=C1)[Si](C)(C)C4107.0Standard non polar33892256
10-Formyldihydrofolate,4TMS,isomer #14C[Si](C)(C)OC(=O)CC[C@@H](C(=O)O)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)N([Si](C)(C)C)C3=O)N([Si](C)(C)C)C2)C=C1)[Si](C)(C)C6592.9Standard polar33892256
10-Formyldihydrofolate,4TMS,isomer #15C[Si](C)(C)OC(=O)[C@H](CCC(=O)O)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N([Si](C)(C)C)[Si](C)(C)C)[NH]C3=O)NC2)C=C1)[Si](C)(C)C4344.6Semi standard non polar33892256
10-Formyldihydrofolate,4TMS,isomer #15C[Si](C)(C)OC(=O)[C@H](CCC(=O)O)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N([Si](C)(C)C)[Si](C)(C)C)[NH]C3=O)NC2)C=C1)[Si](C)(C)C4216.5Standard non polar33892256
10-Formyldihydrofolate,4TMS,isomer #15C[Si](C)(C)OC(=O)[C@H](CCC(=O)O)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N([Si](C)(C)C)[Si](C)(C)C)[NH]C3=O)NC2)C=C1)[Si](C)(C)C6829.5Standard polar33892256
10-Formyldihydrofolate,4TMS,isomer #16C[Si](C)(C)OC(=O)[C@H](CCC(=O)O)NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)C3=O)NC2)C=C14537.2Semi standard non polar33892256
10-Formyldihydrofolate,4TMS,isomer #16C[Si](C)(C)OC(=O)[C@H](CCC(=O)O)NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)C3=O)NC2)C=C14291.9Standard non polar33892256
10-Formyldihydrofolate,4TMS,isomer #16C[Si](C)(C)OC(=O)[C@H](CCC(=O)O)NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)C3=O)NC2)C=C16645.8Standard polar33892256
10-Formyldihydrofolate,4TMS,isomer #17C[Si](C)(C)OC(=O)[C@H](CCC(=O)O)NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N([Si](C)(C)C)[Si](C)(C)C)[NH]C3=O)N([Si](C)(C)C)C2)C=C14334.8Semi standard non polar33892256
10-Formyldihydrofolate,4TMS,isomer #17C[Si](C)(C)OC(=O)[C@H](CCC(=O)O)NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N([Si](C)(C)C)[Si](C)(C)C)[NH]C3=O)N([Si](C)(C)C)C2)C=C14302.6Standard non polar33892256
10-Formyldihydrofolate,4TMS,isomer #17C[Si](C)(C)OC(=O)[C@H](CCC(=O)O)NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N([Si](C)(C)C)[Si](C)(C)C)[NH]C3=O)N([Si](C)(C)C)C2)C=C16623.6Standard polar33892256
10-Formyldihydrofolate,4TMS,isomer #18C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N([C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C=C3)CN2)C(=O)N1[Si](C)(C)C4448.3Semi standard non polar33892256
10-Formyldihydrofolate,4TMS,isomer #18C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N([C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C=C3)CN2)C(=O)N1[Si](C)(C)C4156.8Standard non polar33892256
10-Formyldihydrofolate,4TMS,isomer #18C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N([C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C=C3)CN2)C(=O)N1[Si](C)(C)C6904.3Standard polar33892256
10-Formyldihydrofolate,4TMS,isomer #19C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N[C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C)C=C3)CN2[Si](C)(C)C)C(=O)N1[Si](C)(C)C4423.1Semi standard non polar33892256
10-Formyldihydrofolate,4TMS,isomer #19C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N[C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C)C=C3)CN2[Si](C)(C)C)C(=O)N1[Si](C)(C)C4243.3Standard non polar33892256
10-Formyldihydrofolate,4TMS,isomer #19C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N[C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C)C=C3)CN2[Si](C)(C)C)C(=O)N1[Si](C)(C)C6521.7Standard polar33892256
10-Formyldihydrofolate,4TMS,isomer #2C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N[C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C)C=C3)CN2)C(=O)N1[Si](C)(C)C4472.6Semi standard non polar33892256
10-Formyldihydrofolate,4TMS,isomer #2C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N[C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C)C=C3)CN2)C(=O)N1[Si](C)(C)C4210.8Standard non polar33892256
10-Formyldihydrofolate,4TMS,isomer #2C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N[C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C)C=C3)CN2)C(=O)N1[Si](C)(C)C6972.1Standard polar33892256
10-Formyldihydrofolate,4TMS,isomer #20C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N([C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C=C3)CN2[Si](C)(C)C)C(=O)[NH]14249.2Semi standard non polar33892256
10-Formyldihydrofolate,4TMS,isomer #20C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N([C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C=C3)CN2[Si](C)(C)C)C(=O)[NH]14195.8Standard non polar33892256
10-Formyldihydrofolate,4TMS,isomer #20C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N([C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C=C3)CN2[Si](C)(C)C)C(=O)[NH]16745.9Standard polar33892256
10-Formyldihydrofolate,4TMS,isomer #21C[Si](C)(C)OC(=O)[C@H](CCC(=O)O)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)N([Si](C)(C)C)C3=O)N([Si](C)(C)C)C2)C=C1)[Si](C)(C)C4224.9Semi standard non polar33892256
10-Formyldihydrofolate,4TMS,isomer #21C[Si](C)(C)OC(=O)[C@H](CCC(=O)O)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)N([Si](C)(C)C)C3=O)N([Si](C)(C)C)C2)C=C1)[Si](C)(C)C4084.5Standard non polar33892256
10-Formyldihydrofolate,4TMS,isomer #21C[Si](C)(C)OC(=O)[C@H](CCC(=O)O)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)N([Si](C)(C)C)C3=O)N([Si](C)(C)C)C2)C=C1)[Si](C)(C)C6555.4Standard polar33892256
10-Formyldihydrofolate,4TMS,isomer #22C[Si](C)(C)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)C3=O)NC2)C=C1)[C@@H](CCC(=O)O)C(=O)O4494.9Semi standard non polar33892256
10-Formyldihydrofolate,4TMS,isomer #22C[Si](C)(C)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)C3=O)NC2)C=C1)[C@@H](CCC(=O)O)C(=O)O4264.9Standard non polar33892256
10-Formyldihydrofolate,4TMS,isomer #22C[Si](C)(C)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)C3=O)NC2)C=C1)[C@@H](CCC(=O)O)C(=O)O6638.1Standard polar33892256
10-Formyldihydrofolate,4TMS,isomer #23C[Si](C)(C)N1CC(CN(C=O)C2=CC=C(C(=O)N[C@@H](CCC(=O)O)C(=O)O)C=C2)=NC2=C1N=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)C2=O4520.8Semi standard non polar33892256
10-Formyldihydrofolate,4TMS,isomer #23C[Si](C)(C)N1CC(CN(C=O)C2=CC=C(C(=O)N[C@@H](CCC(=O)O)C(=O)O)C=C2)=NC2=C1N=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)C2=O4381.8Standard non polar33892256
10-Formyldihydrofolate,4TMS,isomer #23C[Si](C)(C)N1CC(CN(C=O)C2=CC=C(C(=O)N[C@@H](CCC(=O)O)C(=O)O)C=C2)=NC2=C1N=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)C2=O6459.3Standard polar33892256
10-Formyldihydrofolate,4TMS,isomer #24C[Si](C)(C)N1CC(CN(C=O)C2=CC=C(C(=O)N([C@@H](CCC(=O)O)C(=O)O)[Si](C)(C)C)C=C2)=NC2=C1N=C(N([Si](C)(C)C)[Si](C)(C)C)[NH]C2=O4279.3Semi standard non polar33892256
10-Formyldihydrofolate,4TMS,isomer #24C[Si](C)(C)N1CC(CN(C=O)C2=CC=C(C(=O)N([C@@H](CCC(=O)O)C(=O)O)[Si](C)(C)C)C=C2)=NC2=C1N=C(N([Si](C)(C)C)[Si](C)(C)C)[NH]C2=O4308.3Standard non polar33892256
10-Formyldihydrofolate,4TMS,isomer #24C[Si](C)(C)N1CC(CN(C=O)C2=CC=C(C(=O)N([C@@H](CCC(=O)O)C(=O)O)[Si](C)(C)C)C=C2)=NC2=C1N=C(N([Si](C)(C)C)[Si](C)(C)C)[NH]C2=O6606.9Standard polar33892256
10-Formyldihydrofolate,4TMS,isomer #25C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N([C@@H](CCC(=O)O)C(=O)O)[Si](C)(C)C)C=C3)CN2[Si](C)(C)C)C(=O)N1[Si](C)(C)C4377.5Semi standard non polar33892256
10-Formyldihydrofolate,4TMS,isomer #25C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N([C@@H](CCC(=O)O)C(=O)O)[Si](C)(C)C)C=C3)CN2[Si](C)(C)C)C(=O)N1[Si](C)(C)C4236.6Standard non polar33892256
10-Formyldihydrofolate,4TMS,isomer #25C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N([C@@H](CCC(=O)O)C(=O)O)[Si](C)(C)C)C=C3)CN2[Si](C)(C)C)C(=O)N1[Si](C)(C)C6505.4Standard polar33892256
10-Formyldihydrofolate,4TMS,isomer #3C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N([C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C=C3)CN2)C(=O)[NH]14341.3Semi standard non polar33892256
10-Formyldihydrofolate,4TMS,isomer #3C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N([C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C=C3)CN2)C(=O)[NH]14175.5Standard non polar33892256
10-Formyldihydrofolate,4TMS,isomer #3C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N([C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C=C3)CN2)C(=O)[NH]17160.0Standard polar33892256
10-Formyldihydrofolate,4TMS,isomer #4C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N[C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C)C=C3)CN2[Si](C)(C)C)C(=O)[NH]14298.4Semi standard non polar33892256
10-Formyldihydrofolate,4TMS,isomer #4C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N[C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C)C=C3)CN2[Si](C)(C)C)C(=O)[NH]14226.5Standard non polar33892256
10-Formyldihydrofolate,4TMS,isomer #4C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N[C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C)C=C3)CN2[Si](C)(C)C)C(=O)[NH]16793.0Standard polar33892256
10-Formyldihydrofolate,4TMS,isomer #5C[Si](C)(C)OC(=O)CC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)N([Si](C)(C)C)C3=O)NC2)C=C1)[Si](C)(C)C4292.6Semi standard non polar33892256
10-Formyldihydrofolate,4TMS,isomer #5C[Si](C)(C)OC(=O)CC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)N([Si](C)(C)C)C3=O)NC2)C=C1)[Si](C)(C)C4018.3Standard non polar33892256
10-Formyldihydrofolate,4TMS,isomer #5C[Si](C)(C)OC(=O)CC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)N([Si](C)(C)C)C3=O)NC2)C=C1)[Si](C)(C)C6700.5Standard polar33892256
10-Formyldihydrofolate,4TMS,isomer #6C[Si](C)(C)OC(=O)CC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)[NH]C3=O)N([Si](C)(C)C)C2)C=C1)[Si](C)(C)C4103.7Semi standard non polar33892256
10-Formyldihydrofolate,4TMS,isomer #6C[Si](C)(C)OC(=O)CC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)[NH]C3=O)N([Si](C)(C)C)C2)C=C1)[Si](C)(C)C4090.2Standard non polar33892256
10-Formyldihydrofolate,4TMS,isomer #6C[Si](C)(C)OC(=O)CC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)[NH]C3=O)N([Si](C)(C)C)C2)C=C1)[Si](C)(C)C6482.7Standard polar33892256
10-Formyldihydrofolate,4TMS,isomer #7C[Si](C)(C)OC(=O)CC[C@H](NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)N([Si](C)(C)C)C3=O)N([Si](C)(C)C)C2)C=C1)C(=O)O[Si](C)(C)C4243.0Semi standard non polar33892256
10-Formyldihydrofolate,4TMS,isomer #7C[Si](C)(C)OC(=O)CC[C@H](NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)N([Si](C)(C)C)C3=O)N([Si](C)(C)C)C2)C=C1)C(=O)O[Si](C)(C)C4108.2Standard non polar33892256
10-Formyldihydrofolate,4TMS,isomer #7C[Si](C)(C)OC(=O)CC[C@H](NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)N([Si](C)(C)C)C3=O)N([Si](C)(C)C)C2)C=C1)C(=O)O[Si](C)(C)C6620.8Standard polar33892256
10-Formyldihydrofolate,4TMS,isomer #8C[Si](C)(C)OC(=O)CC[C@@H](C(=O)O)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N([Si](C)(C)C)[Si](C)(C)C)[NH]C3=O)NC2)C=C1)[Si](C)(C)C4330.0Semi standard non polar33892256
10-Formyldihydrofolate,4TMS,isomer #8C[Si](C)(C)OC(=O)CC[C@@H](C(=O)O)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N([Si](C)(C)C)[Si](C)(C)C)[NH]C3=O)NC2)C=C1)[Si](C)(C)C4257.0Standard non polar33892256
10-Formyldihydrofolate,4TMS,isomer #8C[Si](C)(C)OC(=O)CC[C@@H](C(=O)O)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N([Si](C)(C)C)[Si](C)(C)C)[NH]C3=O)NC2)C=C1)[Si](C)(C)C6870.6Standard polar33892256
10-Formyldihydrofolate,4TMS,isomer #9C[Si](C)(C)OC(=O)CC[C@H](NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)C3=O)NC2)C=C1)C(=O)O4544.1Semi standard non polar33892256
10-Formyldihydrofolate,4TMS,isomer #9C[Si](C)(C)OC(=O)CC[C@H](NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)C3=O)NC2)C=C1)C(=O)O4356.9Standard non polar33892256
10-Formyldihydrofolate,4TMS,isomer #9C[Si](C)(C)OC(=O)CC[C@H](NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)C3=O)NC2)C=C1)C(=O)O6714.4Standard polar33892256
10-Formyldihydrofolate,5TMS,isomer #1C[Si](C)(C)OC(=O)CC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N([Si](C)(C)C)[Si](C)(C)C)[NH]C3=O)NC2)C=C1)[Si](C)(C)C4272.2Semi standard non polar33892256
10-Formyldihydrofolate,5TMS,isomer #1C[Si](C)(C)OC(=O)CC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N([Si](C)(C)C)[Si](C)(C)C)[NH]C3=O)NC2)C=C1)[Si](C)(C)C4224.9Standard non polar33892256
10-Formyldihydrofolate,5TMS,isomer #1C[Si](C)(C)OC(=O)CC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N([Si](C)(C)C)[Si](C)(C)C)[NH]C3=O)NC2)C=C1)[Si](C)(C)C6480.7Standard polar33892256
10-Formyldihydrofolate,5TMS,isomer #10C[Si](C)(C)OC(=O)CC[C@H](NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)C3=O)N([Si](C)(C)C)C2)C=C1)C(=O)O4431.9Semi standard non polar33892256
10-Formyldihydrofolate,5TMS,isomer #10C[Si](C)(C)OC(=O)CC[C@H](NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)C3=O)N([Si](C)(C)C)C2)C=C1)C(=O)O4346.8Standard non polar33892256
10-Formyldihydrofolate,5TMS,isomer #10C[Si](C)(C)OC(=O)CC[C@H](NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)C3=O)N([Si](C)(C)C)C2)C=C1)C(=O)O6126.4Standard polar33892256
10-Formyldihydrofolate,5TMS,isomer #11C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N([C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O)[Si](C)(C)C)C=C3)CN2[Si](C)(C)C)C(=O)N1[Si](C)(C)C4291.1Semi standard non polar33892256
10-Formyldihydrofolate,5TMS,isomer #11C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N([C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O)[Si](C)(C)C)C=C3)CN2[Si](C)(C)C)C(=O)N1[Si](C)(C)C4199.6Standard non polar33892256
10-Formyldihydrofolate,5TMS,isomer #11C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N([C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O)[Si](C)(C)C)C=C3)CN2[Si](C)(C)C)C(=O)N1[Si](C)(C)C6199.3Standard polar33892256
10-Formyldihydrofolate,5TMS,isomer #12C[Si](C)(C)OC(=O)[C@H](CCC(=O)O)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)C3=O)NC2)C=C1)[Si](C)(C)C4392.9Semi standard non polar33892256
10-Formyldihydrofolate,5TMS,isomer #12C[Si](C)(C)OC(=O)[C@H](CCC(=O)O)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)C3=O)NC2)C=C1)[Si](C)(C)C4232.6Standard non polar33892256
10-Formyldihydrofolate,5TMS,isomer #12C[Si](C)(C)OC(=O)[C@H](CCC(=O)O)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)C3=O)NC2)C=C1)[Si](C)(C)C6253.9Standard polar33892256
10-Formyldihydrofolate,5TMS,isomer #13C[Si](C)(C)OC(=O)[C@H](CCC(=O)O)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N([Si](C)(C)C)[Si](C)(C)C)[NH]C3=O)N([Si](C)(C)C)C2)C=C1)[Si](C)(C)C4203.3Semi standard non polar33892256
10-Formyldihydrofolate,5TMS,isomer #13C[Si](C)(C)OC(=O)[C@H](CCC(=O)O)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N([Si](C)(C)C)[Si](C)(C)C)[NH]C3=O)N([Si](C)(C)C)C2)C=C1)[Si](C)(C)C4268.9Standard non polar33892256
10-Formyldihydrofolate,5TMS,isomer #13C[Si](C)(C)OC(=O)[C@H](CCC(=O)O)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N([Si](C)(C)C)[Si](C)(C)C)[NH]C3=O)N([Si](C)(C)C)C2)C=C1)[Si](C)(C)C6258.7Standard polar33892256
10-Formyldihydrofolate,5TMS,isomer #14C[Si](C)(C)OC(=O)[C@H](CCC(=O)O)NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)C3=O)N([Si](C)(C)C)C2)C=C14426.5Semi standard non polar33892256
10-Formyldihydrofolate,5TMS,isomer #14C[Si](C)(C)OC(=O)[C@H](CCC(=O)O)NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)C3=O)N([Si](C)(C)C)C2)C=C14317.4Standard non polar33892256
10-Formyldihydrofolate,5TMS,isomer #14C[Si](C)(C)OC(=O)[C@H](CCC(=O)O)NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)C3=O)N([Si](C)(C)C)C2)C=C16077.3Standard polar33892256
10-Formyldihydrofolate,5TMS,isomer #15C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N([C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C=C3)CN2[Si](C)(C)C)C(=O)N1[Si](C)(C)C4294.9Semi standard non polar33892256
10-Formyldihydrofolate,5TMS,isomer #15C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N([C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C=C3)CN2[Si](C)(C)C)C(=O)N1[Si](C)(C)C4183.4Standard non polar33892256
10-Formyldihydrofolate,5TMS,isomer #15C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N([C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C=C3)CN2[Si](C)(C)C)C(=O)N1[Si](C)(C)C6170.5Standard polar33892256
10-Formyldihydrofolate,5TMS,isomer #16C[Si](C)(C)N1CC(CN(C=O)C2=CC=C(C(=O)N([C@@H](CCC(=O)O)C(=O)O)[Si](C)(C)C)C=C2)=NC2=C1N=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)C2=O4361.1Semi standard non polar33892256
10-Formyldihydrofolate,5TMS,isomer #16C[Si](C)(C)N1CC(CN(C=O)C2=CC=C(C(=O)N([C@@H](CCC(=O)O)C(=O)O)[Si](C)(C)C)C=C2)=NC2=C1N=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)C2=O4329.7Standard non polar33892256
10-Formyldihydrofolate,5TMS,isomer #16C[Si](C)(C)N1CC(CN(C=O)C2=CC=C(C(=O)N([C@@H](CCC(=O)O)C(=O)O)[Si](C)(C)C)C=C2)=NC2=C1N=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)C2=O6073.7Standard polar33892256
10-Formyldihydrofolate,5TMS,isomer #2C[Si](C)(C)OC(=O)CC[C@H](NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)C3=O)NC2)C=C1)C(=O)O[Si](C)(C)C4439.9Semi standard non polar33892256
10-Formyldihydrofolate,5TMS,isomer #2C[Si](C)(C)OC(=O)CC[C@H](NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)C3=O)NC2)C=C1)C(=O)O[Si](C)(C)C4266.0Standard non polar33892256
10-Formyldihydrofolate,5TMS,isomer #2C[Si](C)(C)OC(=O)CC[C@H](NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)C3=O)NC2)C=C1)C(=O)O[Si](C)(C)C6288.0Standard polar33892256
10-Formyldihydrofolate,5TMS,isomer #3C[Si](C)(C)OC(=O)CC[C@H](NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N([Si](C)(C)C)[Si](C)(C)C)[NH]C3=O)N([Si](C)(C)C)C2)C=C1)C(=O)O[Si](C)(C)C4274.8Semi standard non polar33892256
10-Formyldihydrofolate,5TMS,isomer #3C[Si](C)(C)OC(=O)CC[C@H](NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N([Si](C)(C)C)[Si](C)(C)C)[NH]C3=O)N([Si](C)(C)C)C2)C=C1)C(=O)O[Si](C)(C)C4278.9Standard non polar33892256
10-Formyldihydrofolate,5TMS,isomer #3C[Si](C)(C)OC(=O)CC[C@H](NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N([Si](C)(C)C)[Si](C)(C)C)[NH]C3=O)N([Si](C)(C)C)C2)C=C1)C(=O)O[Si](C)(C)C6297.6Standard polar33892256
10-Formyldihydrofolate,5TMS,isomer #4C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N([C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C=C3)CN2)C(=O)N1[Si](C)(C)C4351.6Semi standard non polar33892256
10-Formyldihydrofolate,5TMS,isomer #4C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N([C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C=C3)CN2)C(=O)N1[Si](C)(C)C4140.8Standard non polar33892256
10-Formyldihydrofolate,5TMS,isomer #4C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N([C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C=C3)CN2)C(=O)N1[Si](C)(C)C6574.1Standard polar33892256
10-Formyldihydrofolate,5TMS,isomer #5C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N[C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C)C=C3)CN2[Si](C)(C)C)C(=O)N1[Si](C)(C)C4321.0Semi standard non polar33892256
10-Formyldihydrofolate,5TMS,isomer #5C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N[C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C)C=C3)CN2[Si](C)(C)C)C(=O)N1[Si](C)(C)C4190.5Standard non polar33892256
10-Formyldihydrofolate,5TMS,isomer #5C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N[C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C)C=C3)CN2[Si](C)(C)C)C(=O)N1[Si](C)(C)C6196.0Standard polar33892256
10-Formyldihydrofolate,5TMS,isomer #6C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N([C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C=C3)CN2[Si](C)(C)C)C(=O)[NH]14187.7Semi standard non polar33892256
10-Formyldihydrofolate,5TMS,isomer #6C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N([C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C=C3)CN2[Si](C)(C)C)C(=O)[NH]14168.2Standard non polar33892256
10-Formyldihydrofolate,5TMS,isomer #6C[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N([C@@H](CCC(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C)[Si](C)(C)C)C=C3)CN2[Si](C)(C)C)C(=O)[NH]16417.1Standard polar33892256
10-Formyldihydrofolate,5TMS,isomer #7C[Si](C)(C)OC(=O)CC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)N([Si](C)(C)C)C3=O)N([Si](C)(C)C)C2)C=C1)[Si](C)(C)C4156.4Semi standard non polar33892256
10-Formyldihydrofolate,5TMS,isomer #7C[Si](C)(C)OC(=O)CC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)N([Si](C)(C)C)C3=O)N([Si](C)(C)C)C2)C=C1)[Si](C)(C)C4058.1Standard non polar33892256
10-Formyldihydrofolate,5TMS,isomer #7C[Si](C)(C)OC(=O)CC[C@@H](C(=O)O[Si](C)(C)C)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)N([Si](C)(C)C)C3=O)N([Si](C)(C)C)C2)C=C1)[Si](C)(C)C6325.9Standard polar33892256
10-Formyldihydrofolate,5TMS,isomer #8C[Si](C)(C)OC(=O)CC[C@@H](C(=O)O)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)C3=O)NC2)C=C1)[Si](C)(C)C4386.3Semi standard non polar33892256
10-Formyldihydrofolate,5TMS,isomer #8C[Si](C)(C)OC(=O)CC[C@@H](C(=O)O)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)C3=O)NC2)C=C1)[Si](C)(C)C4257.2Standard non polar33892256
10-Formyldihydrofolate,5TMS,isomer #8C[Si](C)(C)OC(=O)CC[C@@H](C(=O)O)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)C3=O)NC2)C=C1)[Si](C)(C)C6283.7Standard polar33892256
10-Formyldihydrofolate,5TMS,isomer #9C[Si](C)(C)OC(=O)CC[C@@H](C(=O)O)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N([Si](C)(C)C)[Si](C)(C)C)[NH]C3=O)N([Si](C)(C)C)C2)C=C1)[Si](C)(C)C4206.5Semi standard non polar33892256
10-Formyldihydrofolate,5TMS,isomer #9C[Si](C)(C)OC(=O)CC[C@@H](C(=O)O)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N([Si](C)(C)C)[Si](C)(C)C)[NH]C3=O)N([Si](C)(C)C)C2)C=C1)[Si](C)(C)C4297.3Standard non polar33892256
10-Formyldihydrofolate,5TMS,isomer #9C[Si](C)(C)OC(=O)CC[C@@H](C(=O)O)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N([Si](C)(C)C)[Si](C)(C)C)[NH]C3=O)N([Si](C)(C)C)C2)C=C1)[Si](C)(C)C6287.4Standard polar33892256
10-Formyldihydrofolate,1TBDMS,isomer #1CC(C)(C)[Si](C)(C)OC(=O)CC[C@H](NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)[NH]C3=O)NC2)C=C1)C(=O)O4991.6Semi standard non polar33892256
10-Formyldihydrofolate,1TBDMS,isomer #2CC(C)(C)[Si](C)(C)OC(=O)[C@H](CCC(=O)O)NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)[NH]C3=O)NC2)C=C14952.1Semi standard non polar33892256
10-Formyldihydrofolate,1TBDMS,isomer #3CC(C)(C)[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N[C@@H](CCC(=O)O)C(=O)O)C=C3)CN2)C(=O)[NH]15068.7Semi standard non polar33892256
10-Formyldihydrofolate,1TBDMS,isomer #4CC(C)(C)[Si](C)(C)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)[NH]C3=O)NC2)C=C1)[C@@H](CCC(=O)O)C(=O)O4931.8Semi standard non polar33892256
10-Formyldihydrofolate,1TBDMS,isomer #5CC(C)(C)[Si](C)(C)N1CC(CN(C=O)C2=CC=C(C(=O)N[C@@H](CCC(=O)O)C(=O)O)C=C2)=NC2=C1N=C(N)[NH]C2=O4877.8Semi standard non polar33892256
10-Formyldihydrofolate,1TBDMS,isomer #6CC(C)(C)[Si](C)(C)N1C(N)=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N[C@@H](CCC(=O)O)C(=O)O)C=C3)CN2)C1=O4965.9Semi standard non polar33892256
10-Formyldihydrofolate,2TBDMS,isomer #1CC(C)(C)[Si](C)(C)OC(=O)CC[C@H](NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)[NH]C3=O)NC2)C=C1)C(=O)O[Si](C)(C)C(C)(C)C4992.9Semi standard non polar33892256
10-Formyldihydrofolate,2TBDMS,isomer #10CC(C)(C)[Si](C)(C)N(C1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N[C@@H](CCC(=O)O)C(=O)O)C=C3)CN2)C(=O)[NH]1)[Si](C)(C)C(C)(C)C5110.2Semi standard non polar33892256
10-Formyldihydrofolate,2TBDMS,isomer #11CC(C)(C)[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N[C@@H](CCC(=O)O)C(=O)O)C=C3)CN2)C(=O)N1[Si](C)(C)C(C)(C)C5179.7Semi standard non polar33892256
10-Formyldihydrofolate,2TBDMS,isomer #12CC(C)(C)[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N([C@@H](CCC(=O)O)C(=O)O)[Si](C)(C)C(C)(C)C)C=C3)CN2)C(=O)[NH]15040.4Semi standard non polar33892256
10-Formyldihydrofolate,2TBDMS,isomer #13CC(C)(C)[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N[C@@H](CCC(=O)O)C(=O)O)C=C3)CN2[Si](C)(C)C(C)(C)C)C(=O)[NH]15011.2Semi standard non polar33892256
10-Formyldihydrofolate,2TBDMS,isomer #14CC(C)(C)[Si](C)(C)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)N([Si](C)(C)C(C)(C)C)C3=O)NC2)C=C1)[C@@H](CCC(=O)O)C(=O)O5011.5Semi standard non polar33892256
10-Formyldihydrofolate,2TBDMS,isomer #15CC(C)(C)[Si](C)(C)N1CC(CN(C=O)C2=CC=C(C(=O)N([C@@H](CCC(=O)O)C(=O)O)[Si](C)(C)C(C)(C)C)C=C2)=NC2=C1N=C(N)[NH]C2=O4871.6Semi standard non polar33892256
10-Formyldihydrofolate,2TBDMS,isomer #16CC(C)(C)[Si](C)(C)N1CC(CN(C=O)C2=CC=C(C(=O)N[C@@H](CCC(=O)O)C(=O)O)C=C2)=NC2=C1N=C(N)N([Si](C)(C)C(C)(C)C)C2=O5019.1Semi standard non polar33892256
10-Formyldihydrofolate,2TBDMS,isomer #2CC(C)(C)[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N[C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)O)C=C3)CN2)C(=O)[NH]15063.3Semi standard non polar33892256
10-Formyldihydrofolate,2TBDMS,isomer #3CC(C)(C)[Si](C)(C)OC(=O)CC[C@@H](C(=O)O)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)[NH]C3=O)NC2)C=C1)[Si](C)(C)C(C)(C)C4949.7Semi standard non polar33892256
10-Formyldihydrofolate,2TBDMS,isomer #4CC(C)(C)[Si](C)(C)OC(=O)CC[C@H](NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)N([Si](C)(C)C(C)(C)C)C3=O)NC2)C=C1)C(=O)O5062.4Semi standard non polar33892256
10-Formyldihydrofolate,2TBDMS,isomer #5CC(C)(C)[Si](C)(C)OC(=O)CC[C@H](NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)[NH]C3=O)N([Si](C)(C)C(C)(C)C)C2)C=C1)C(=O)O4912.0Semi standard non polar33892256
10-Formyldihydrofolate,2TBDMS,isomer #6CC(C)(C)[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N[C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C(C)(C)C)C=C3)CN2)C(=O)[NH]15053.0Semi standard non polar33892256
10-Formyldihydrofolate,2TBDMS,isomer #7CC(C)(C)[Si](C)(C)OC(=O)[C@H](CCC(=O)O)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)[NH]C3=O)NC2)C=C1)[Si](C)(C)C(C)(C)C4951.8Semi standard non polar33892256
10-Formyldihydrofolate,2TBDMS,isomer #8CC(C)(C)[Si](C)(C)OC(=O)[C@H](CCC(=O)O)NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)N([Si](C)(C)C(C)(C)C)C3=O)NC2)C=C15039.9Semi standard non polar33892256
10-Formyldihydrofolate,2TBDMS,isomer #9CC(C)(C)[Si](C)(C)OC(=O)[C@H](CCC(=O)O)NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)[NH]C3=O)N([Si](C)(C)C(C)(C)C)C2)C=C14895.2Semi standard non polar33892256
10-Formyldihydrofolate,3TBDMS,isomer #1CC(C)(C)[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N[C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C)C=C3)CN2)C(=O)[NH]15016.7Semi standard non polar33892256
10-Formyldihydrofolate,3TBDMS,isomer #1CC(C)(C)[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N[C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C)C=C3)CN2)C(=O)[NH]14784.5Standard non polar33892256
10-Formyldihydrofolate,3TBDMS,isomer #1CC(C)(C)[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N[C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C)C=C3)CN2)C(=O)[NH]17276.4Standard polar33892256
10-Formyldihydrofolate,3TBDMS,isomer #10CC(C)(C)[Si](C)(C)OC(=O)CC[C@@H](C(=O)O)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)[NH]C3=O)N([Si](C)(C)C(C)(C)C)C2)C=C1)[Si](C)(C)C(C)(C)C4876.0Semi standard non polar33892256
10-Formyldihydrofolate,3TBDMS,isomer #10CC(C)(C)[Si](C)(C)OC(=O)CC[C@@H](C(=O)O)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)[NH]C3=O)N([Si](C)(C)C(C)(C)C)C2)C=C1)[Si](C)(C)C(C)(C)C4614.2Standard non polar33892256
10-Formyldihydrofolate,3TBDMS,isomer #10CC(C)(C)[Si](C)(C)OC(=O)CC[C@@H](C(=O)O)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)[NH]C3=O)N([Si](C)(C)C(C)(C)C)C2)C=C1)[Si](C)(C)C(C)(C)C6616.0Standard polar33892256
10-Formyldihydrofolate,3TBDMS,isomer #11CC(C)(C)[Si](C)(C)OC(=O)CC[C@H](NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)N([Si](C)(C)C(C)(C)C)C3=O)N([Si](C)(C)C(C)(C)C)C2)C=C1)C(=O)O5076.0Semi standard non polar33892256
10-Formyldihydrofolate,3TBDMS,isomer #11CC(C)(C)[Si](C)(C)OC(=O)CC[C@H](NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)N([Si](C)(C)C(C)(C)C)C3=O)N([Si](C)(C)C(C)(C)C)C2)C=C1)C(=O)O4673.9Standard non polar33892256
10-Formyldihydrofolate,3TBDMS,isomer #11CC(C)(C)[Si](C)(C)OC(=O)CC[C@H](NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)N([Si](C)(C)C(C)(C)C)C3=O)N([Si](C)(C)C(C)(C)C)C2)C=C1)C(=O)O6713.6Standard polar33892256
10-Formyldihydrofolate,3TBDMS,isomer #12CC(C)(C)[Si](C)(C)OC(=O)[C@H](CCC(=O)O)NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[NH]C3=O)NC2)C=C15104.8Semi standard non polar33892256
10-Formyldihydrofolate,3TBDMS,isomer #12CC(C)(C)[Si](C)(C)OC(=O)[C@H](CCC(=O)O)NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[NH]C3=O)NC2)C=C14796.3Standard non polar33892256
10-Formyldihydrofolate,3TBDMS,isomer #12CC(C)(C)[Si](C)(C)OC(=O)[C@H](CCC(=O)O)NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[NH]C3=O)NC2)C=C16957.1Standard polar33892256
10-Formyldihydrofolate,3TBDMS,isomer #13CC(C)(C)[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N[C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C(C)(C)C)C=C3)CN2)C(=O)N1[Si](C)(C)C(C)(C)C5175.4Semi standard non polar33892256
10-Formyldihydrofolate,3TBDMS,isomer #13CC(C)(C)[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N[C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C(C)(C)C)C=C3)CN2)C(=O)N1[Si](C)(C)C(C)(C)C4760.9Standard non polar33892256
10-Formyldihydrofolate,3TBDMS,isomer #13CC(C)(C)[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N[C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C(C)(C)C)C=C3)CN2)C(=O)N1[Si](C)(C)C(C)(C)C6993.9Standard polar33892256
10-Formyldihydrofolate,3TBDMS,isomer #14CC(C)(C)[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N([C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C=C3)CN2)C(=O)[NH]14999.8Semi standard non polar33892256
10-Formyldihydrofolate,3TBDMS,isomer #14CC(C)(C)[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N([C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C=C3)CN2)C(=O)[NH]14717.0Standard non polar33892256
10-Formyldihydrofolate,3TBDMS,isomer #14CC(C)(C)[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N([C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)C=C3)CN2)C(=O)[NH]17219.1Standard polar33892256
10-Formyldihydrofolate,3TBDMS,isomer #15CC(C)(C)[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N[C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C(C)(C)C)C=C3)CN2[Si](C)(C)C(C)(C)C)C(=O)[NH]14978.9Semi standard non polar33892256
10-Formyldihydrofolate,3TBDMS,isomer #15CC(C)(C)[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N[C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C(C)(C)C)C=C3)CN2[Si](C)(C)C(C)(C)C)C(=O)[NH]14780.1Standard non polar33892256
10-Formyldihydrofolate,3TBDMS,isomer #15CC(C)(C)[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N[C@@H](CCC(=O)O)C(=O)O[Si](C)(C)C(C)(C)C)C=C3)CN2[Si](C)(C)C(C)(C)C)C(=O)[NH]16917.7Standard polar33892256
10-Formyldihydrofolate,3TBDMS,isomer #16CC(C)(C)[Si](C)(C)OC(=O)[C@H](CCC(=O)O)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)N([Si](C)(C)C(C)(C)C)C3=O)NC2)C=C1)[Si](C)(C)C(C)(C)C5041.0Semi standard non polar33892256
10-Formyldihydrofolate,3TBDMS,isomer #16CC(C)(C)[Si](C)(C)OC(=O)[C@H](CCC(=O)O)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)N([Si](C)(C)C(C)(C)C)C3=O)NC2)C=C1)[Si](C)(C)C(C)(C)C4549.7Standard non polar33892256
10-Formyldihydrofolate,3TBDMS,isomer #16CC(C)(C)[Si](C)(C)OC(=O)[C@H](CCC(=O)O)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)N([Si](C)(C)C(C)(C)C)C3=O)NC2)C=C1)[Si](C)(C)C(C)(C)C6721.9Standard polar33892256
10-Formyldihydrofolate,3TBDMS,isomer #17CC(C)(C)[Si](C)(C)OC(=O)[C@H](CCC(=O)O)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)[NH]C3=O)N([Si](C)(C)C(C)(C)C)C2)C=C1)[Si](C)(C)C(C)(C)C4875.1Semi standard non polar33892256
10-Formyldihydrofolate,3TBDMS,isomer #17CC(C)(C)[Si](C)(C)OC(=O)[C@H](CCC(=O)O)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)[NH]C3=O)N([Si](C)(C)C(C)(C)C)C2)C=C1)[Si](C)(C)C(C)(C)C4597.8Standard non polar33892256
10-Formyldihydrofolate,3TBDMS,isomer #17CC(C)(C)[Si](C)(C)OC(=O)[C@H](CCC(=O)O)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)[NH]C3=O)N([Si](C)(C)C(C)(C)C)C2)C=C1)[Si](C)(C)C(C)(C)C6593.4Standard polar33892256
10-Formyldihydrofolate,3TBDMS,isomer #18CC(C)(C)[Si](C)(C)OC(=O)[C@H](CCC(=O)O)NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)N([Si](C)(C)C(C)(C)C)C3=O)N([Si](C)(C)C(C)(C)C)C2)C=C15057.3Semi standard non polar33892256
10-Formyldihydrofolate,3TBDMS,isomer #18CC(C)(C)[Si](C)(C)OC(=O)[C@H](CCC(=O)O)NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)N([Si](C)(C)C(C)(C)C)C3=O)N([Si](C)(C)C(C)(C)C)C2)C=C14645.5Standard non polar33892256
10-Formyldihydrofolate,3TBDMS,isomer #18CC(C)(C)[Si](C)(C)OC(=O)[C@H](CCC(=O)O)NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)N([Si](C)(C)C(C)(C)C)C3=O)N([Si](C)(C)C(C)(C)C)C2)C=C16666.5Standard polar33892256
10-Formyldihydrofolate,3TBDMS,isomer #19CC(C)(C)[Si](C)(C)N(C1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N[C@@H](CCC(=O)O)C(=O)O)C=C3)CN2)C(=O)N1[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C5268.2Semi standard non polar33892256
10-Formyldihydrofolate,3TBDMS,isomer #19CC(C)(C)[Si](C)(C)N(C1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N[C@@H](CCC(=O)O)C(=O)O)C=C3)CN2)C(=O)N1[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C4844.7Standard non polar33892256
10-Formyldihydrofolate,3TBDMS,isomer #19CC(C)(C)[Si](C)(C)N(C1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N[C@@H](CCC(=O)O)C(=O)O)C=C3)CN2)C(=O)N1[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C6937.7Standard polar33892256
10-Formyldihydrofolate,3TBDMS,isomer #2CC(C)(C)[Si](C)(C)OC(=O)CC[C@@H](C(=O)O[Si](C)(C)C(C)(C)C)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)[NH]C3=O)NC2)C=C1)[Si](C)(C)C(C)(C)C4957.4Semi standard non polar33892256
10-Formyldihydrofolate,3TBDMS,isomer #2CC(C)(C)[Si](C)(C)OC(=O)CC[C@@H](C(=O)O[Si](C)(C)C(C)(C)C)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)[NH]C3=O)NC2)C=C1)[Si](C)(C)C(C)(C)C4551.8Standard non polar33892256
10-Formyldihydrofolate,3TBDMS,isomer #2CC(C)(C)[Si](C)(C)OC(=O)CC[C@@H](C(=O)O[Si](C)(C)C(C)(C)C)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)[NH]C3=O)NC2)C=C1)[Si](C)(C)C(C)(C)C6693.1Standard polar33892256
10-Formyldihydrofolate,3TBDMS,isomer #20CC(C)(C)[Si](C)(C)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[NH]C3=O)NC2)C=C1)[C@@H](CCC(=O)O)C(=O)O5080.0Semi standard non polar33892256
10-Formyldihydrofolate,3TBDMS,isomer #20CC(C)(C)[Si](C)(C)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[NH]C3=O)NC2)C=C1)[C@@H](CCC(=O)O)C(=O)O4750.8Standard non polar33892256
10-Formyldihydrofolate,3TBDMS,isomer #20CC(C)(C)[Si](C)(C)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[NH]C3=O)NC2)C=C1)[C@@H](CCC(=O)O)C(=O)O6924.0Standard polar33892256
10-Formyldihydrofolate,3TBDMS,isomer #21CC(C)(C)[Si](C)(C)N1CC(CN(C=O)C2=CC=C(C(=O)N[C@@H](CCC(=O)O)C(=O)O)C=C2)=NC2=C1N=C(N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[NH]C2=O5072.3Semi standard non polar33892256
10-Formyldihydrofolate,3TBDMS,isomer #21CC(C)(C)[Si](C)(C)N1CC(CN(C=O)C2=CC=C(C(=O)N[C@@H](CCC(=O)O)C(=O)O)C=C2)=NC2=C1N=C(N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[NH]C2=O4830.3Standard non polar33892256
10-Formyldihydrofolate,3TBDMS,isomer #21CC(C)(C)[Si](C)(C)N1CC(CN(C=O)C2=CC=C(C(=O)N[C@@H](CCC(=O)O)C(=O)O)C=C2)=NC2=C1N=C(N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[NH]C2=O6793.8Standard polar33892256
10-Formyldihydrofolate,3TBDMS,isomer #22CC(C)(C)[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N([C@@H](CCC(=O)O)C(=O)O)[Si](C)(C)C(C)(C)C)C=C3)CN2)C(=O)N1[Si](C)(C)C(C)(C)C5155.3Semi standard non polar33892256
10-Formyldihydrofolate,3TBDMS,isomer #22CC(C)(C)[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N([C@@H](CCC(=O)O)C(=O)O)[Si](C)(C)C(C)(C)C)C=C3)CN2)C(=O)N1[Si](C)(C)C(C)(C)C4713.8Standard non polar33892256
10-Formyldihydrofolate,3TBDMS,isomer #22CC(C)(C)[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N([C@@H](CCC(=O)O)C(=O)O)[Si](C)(C)C(C)(C)C)C=C3)CN2)C(=O)N1[Si](C)(C)C(C)(C)C6953.9Standard polar33892256
10-Formyldihydrofolate,3TBDMS,isomer #23CC(C)(C)[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N[C@@H](CCC(=O)O)C(=O)O)C=C3)CN2[Si](C)(C)C(C)(C)C)C(=O)N1[Si](C)(C)C(C)(C)C5177.0Semi standard non polar33892256
10-Formyldihydrofolate,3TBDMS,isomer #23CC(C)(C)[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N[C@@H](CCC(=O)O)C(=O)O)C=C3)CN2[Si](C)(C)C(C)(C)C)C(=O)N1[Si](C)(C)C(C)(C)C4823.1Standard non polar33892256
10-Formyldihydrofolate,3TBDMS,isomer #23CC(C)(C)[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N[C@@H](CCC(=O)O)C(=O)O)C=C3)CN2[Si](C)(C)C(C)(C)C)C(=O)N1[Si](C)(C)C(C)(C)C6669.9Standard polar33892256
10-Formyldihydrofolate,3TBDMS,isomer #24CC(C)(C)[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N([C@@H](CCC(=O)O)C(=O)O)[Si](C)(C)C(C)(C)C)C=C3)CN2[Si](C)(C)C(C)(C)C)C(=O)[NH]14986.8Semi standard non polar33892256
10-Formyldihydrofolate,3TBDMS,isomer #24CC(C)(C)[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N([C@@H](CCC(=O)O)C(=O)O)[Si](C)(C)C(C)(C)C)C=C3)CN2[Si](C)(C)C(C)(C)C)C(=O)[NH]14756.2Standard non polar33892256
10-Formyldihydrofolate,3TBDMS,isomer #24CC(C)(C)[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N([C@@H](CCC(=O)O)C(=O)O)[Si](C)(C)C(C)(C)C)C=C3)CN2[Si](C)(C)C(C)(C)C)C(=O)[NH]16894.2Standard polar33892256
10-Formyldihydrofolate,3TBDMS,isomer #25CC(C)(C)[Si](C)(C)N1CC(CN(C=O)C2=CC=C(C(=O)N([C@@H](CCC(=O)O)C(=O)O)[Si](C)(C)C(C)(C)C)C=C2)=NC2=C1N=C(N)N([Si](C)(C)C(C)(C)C)C2=O5024.1Semi standard non polar33892256
10-Formyldihydrofolate,3TBDMS,isomer #25CC(C)(C)[Si](C)(C)N1CC(CN(C=O)C2=CC=C(C(=O)N([C@@H](CCC(=O)O)C(=O)O)[Si](C)(C)C(C)(C)C)C=C2)=NC2=C1N=C(N)N([Si](C)(C)C(C)(C)C)C2=O4628.7Standard non polar33892256
10-Formyldihydrofolate,3TBDMS,isomer #25CC(C)(C)[Si](C)(C)N1CC(CN(C=O)C2=CC=C(C(=O)N([C@@H](CCC(=O)O)C(=O)O)[Si](C)(C)C(C)(C)C)C=C2)=NC2=C1N=C(N)N([Si](C)(C)C(C)(C)C)C2=O6653.7Standard polar33892256
10-Formyldihydrofolate,3TBDMS,isomer #3CC(C)(C)[Si](C)(C)OC(=O)CC[C@H](NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)N([Si](C)(C)C(C)(C)C)C3=O)NC2)C=C1)C(=O)O[Si](C)(C)C(C)(C)C5062.0Semi standard non polar33892256
10-Formyldihydrofolate,3TBDMS,isomer #3CC(C)(C)[Si](C)(C)OC(=O)CC[C@H](NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)N([Si](C)(C)C(C)(C)C)C3=O)NC2)C=C1)C(=O)O[Si](C)(C)C(C)(C)C4598.5Standard non polar33892256
10-Formyldihydrofolate,3TBDMS,isomer #3CC(C)(C)[Si](C)(C)OC(=O)CC[C@H](NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)N([Si](C)(C)C(C)(C)C)C3=O)NC2)C=C1)C(=O)O[Si](C)(C)C(C)(C)C6767.3Standard polar33892256
10-Formyldihydrofolate,3TBDMS,isomer #4CC(C)(C)[Si](C)(C)OC(=O)CC[C@H](NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)[NH]C3=O)N([Si](C)(C)C(C)(C)C)C2)C=C1)C(=O)O[Si](C)(C)C(C)(C)C4894.0Semi standard non polar33892256
10-Formyldihydrofolate,3TBDMS,isomer #4CC(C)(C)[Si](C)(C)OC(=O)CC[C@H](NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)[NH]C3=O)N([Si](C)(C)C(C)(C)C)C2)C=C1)C(=O)O[Si](C)(C)C(C)(C)C4627.5Standard non polar33892256
10-Formyldihydrofolate,3TBDMS,isomer #4CC(C)(C)[Si](C)(C)OC(=O)CC[C@H](NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)[NH]C3=O)N([Si](C)(C)C(C)(C)C)C2)C=C1)C(=O)O[Si](C)(C)C(C)(C)C6642.2Standard polar33892256
10-Formyldihydrofolate,3TBDMS,isomer #5CC(C)(C)[Si](C)(C)OC(=O)CC[C@H](NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[NH]C3=O)NC2)C=C1)C(=O)O5112.1Semi standard non polar33892256
10-Formyldihydrofolate,3TBDMS,isomer #5CC(C)(C)[Si](C)(C)OC(=O)CC[C@H](NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[NH]C3=O)NC2)C=C1)C(=O)O4857.9Standard non polar33892256
10-Formyldihydrofolate,3TBDMS,isomer #5CC(C)(C)[Si](C)(C)OC(=O)CC[C@H](NC(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)[NH]C3=O)NC2)C=C1)C(=O)O7001.5Standard polar33892256
10-Formyldihydrofolate,3TBDMS,isomer #6CC(C)(C)[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N[C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)O)C=C3)CN2)C(=O)N1[Si](C)(C)C(C)(C)C5186.2Semi standard non polar33892256
10-Formyldihydrofolate,3TBDMS,isomer #6CC(C)(C)[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N[C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)O)C=C3)CN2)C(=O)N1[Si](C)(C)C(C)(C)C4815.3Standard non polar33892256
10-Formyldihydrofolate,3TBDMS,isomer #6CC(C)(C)[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N[C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)O)C=C3)CN2)C(=O)N1[Si](C)(C)C(C)(C)C7035.7Standard polar33892256
10-Formyldihydrofolate,3TBDMS,isomer #7CC(C)(C)[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N([C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)O)[Si](C)(C)C(C)(C)C)C=C3)CN2)C(=O)[NH]14996.7Semi standard non polar33892256
10-Formyldihydrofolate,3TBDMS,isomer #7CC(C)(C)[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N([C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)O)[Si](C)(C)C(C)(C)C)C=C3)CN2)C(=O)[NH]14739.2Standard non polar33892256
10-Formyldihydrofolate,3TBDMS,isomer #7CC(C)(C)[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N([C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)O)[Si](C)(C)C(C)(C)C)C=C3)CN2)C(=O)[NH]17238.4Standard polar33892256
10-Formyldihydrofolate,3TBDMS,isomer #8CC(C)(C)[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N[C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)O)C=C3)CN2[Si](C)(C)C(C)(C)C)C(=O)[NH]14998.3Semi standard non polar33892256
10-Formyldihydrofolate,3TBDMS,isomer #8CC(C)(C)[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N[C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)O)C=C3)CN2[Si](C)(C)C(C)(C)C)C(=O)[NH]14817.6Standard non polar33892256
10-Formyldihydrofolate,3TBDMS,isomer #8CC(C)(C)[Si](C)(C)NC1=NC2=C(N=C(CN(C=O)C3=CC=C(C(=O)N[C@@H](CCC(=O)O[Si](C)(C)C(C)(C)C)C(=O)O)C=C3)CN2[Si](C)(C)C(C)(C)C)C(=O)[NH]16959.0Standard polar33892256
10-Formyldihydrofolate,3TBDMS,isomer #9CC(C)(C)[Si](C)(C)OC(=O)CC[C@@H](C(=O)O)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)N([Si](C)(C)C(C)(C)C)C3=O)NC2)C=C1)[Si](C)(C)C(C)(C)C5046.8Semi standard non polar33892256
10-Formyldihydrofolate,3TBDMS,isomer #9CC(C)(C)[Si](C)(C)OC(=O)CC[C@@H](C(=O)O)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)N([Si](C)(C)C(C)(C)C)C3=O)NC2)C=C1)[Si](C)(C)C(C)(C)C4560.0Standard non polar33892256
10-Formyldihydrofolate,3TBDMS,isomer #9CC(C)(C)[Si](C)(C)OC(=O)CC[C@@H](C(=O)O)N(C(=O)C1=CC=C(N(C=O)CC2=NC3=C(N=C(N)N([Si](C)(C)C(C)(C)C)C3=O)NC2)C=C1)[Si](C)(C)C(C)(C)C6743.7Standard polar33892256
Spectra

GC-MS Spectra

Spectrum TypeDescriptionSplash KeyDeposition DateSourceView
Predicted GC-MSPredicted GC-MS Spectrum - 10-Formyldihydrofolate GC-MS (Non-derivatized) - 70eV, Positivesplash10-002b-2677900000-d63b78529e7720c7d76b2017-09-01Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - 10-Formyldihydrofolate GC-MS (2 TMS) - 70eV, Positivesplash10-00fr-7219863000-81e4d17f4e1531c8674c2017-10-06Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - 10-Formyldihydrofolate GC-MS (Non-derivatized) - 70eV, PositiveNot Available2021-10-12Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - 10-Formyldihydrofolate GC-MS (Non-derivatized) - 70eV, PositiveNot Available2021-10-12Wishart LabView Spectrum

MS/MS Spectra

Spectrum TypeDescriptionSplash KeyDeposition DateSourceView
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 10-Formyldihydrofolate 10V, Positive-QTOFsplash10-0fb9-0300900000-ee4c7216428a12cfd2982017-09-01Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 10-Formyldihydrofolate 20V, Positive-QTOFsplash10-004i-0646900000-d899d6171b33c5c8cf4e2017-09-01Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 10-Formyldihydrofolate 40V, Positive-QTOFsplash10-004r-0920000000-76564757defeef5f35082017-09-01Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 10-Formyldihydrofolate 10V, Negative-QTOFsplash10-00di-0000900000-f04c0efc195b89e2311c2017-09-01Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 10-Formyldihydrofolate 20V, Negative-QTOFsplash10-006w-0015900000-7cbcd449fe6a5c2049512017-09-01Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 10-Formyldihydrofolate 40V, Negative-QTOFsplash10-0006-9651100000-2958845f39ef795999bb2017-09-01Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 10-Formyldihydrofolate 10V, Positive-QTOFsplash10-002f-0011900000-b591888bb7086b05e8a72021-09-22Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 10-Formyldihydrofolate 20V, Positive-QTOFsplash10-004j-1769500000-82a205e02d66aff94cdf2021-09-22Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 10-Formyldihydrofolate 40V, Positive-QTOFsplash10-01rt-0931000000-cf525f4b0c5619cd2d922021-09-22Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 10-Formyldihydrofolate 10V, Negative-QTOFsplash10-00di-0000900000-b474b2540ed9386a184e2021-09-22Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 10-Formyldihydrofolate 20V, Negative-QTOFsplash10-00fr-1234900000-cf4b65124dd43d38b8222021-09-22Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 10-Formyldihydrofolate 40V, Negative-QTOFsplash10-0fr6-5942300000-4aa8c668e5c2dc8e59242021-09-22Wishart LabView Spectrum

NMR Spectra

Spectrum TypeDescriptionDeposition DateSourceView
Predicted 1D NMR1H NMR Spectrum (1D, 100 MHz, D2O, predicted)2021-09-16Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 100 MHz, D2O, predicted)2021-09-16Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 200 MHz, D2O, predicted)2021-09-16Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 200 MHz, D2O, predicted)2021-09-16Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 300 MHz, D2O, predicted)2021-09-16Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 300 MHz, D2O, predicted)2021-09-16Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 400 MHz, D2O, predicted)2021-09-16Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 400 MHz, D2O, predicted)2021-09-16Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 500 MHz, D2O, predicted)2021-09-16Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 500 MHz, D2O, predicted)2021-09-16Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 600 MHz, D2O, predicted)2021-09-16Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 600 MHz, D2O, predicted)2021-09-16Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 700 MHz, D2O, predicted)2021-09-16Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 700 MHz, D2O, predicted)2021-09-16Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 800 MHz, D2O, predicted)2021-09-16Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 800 MHz, D2O, predicted)2021-09-16Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 900 MHz, D2O, predicted)2021-09-16Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 900 MHz, D2O, predicted)2021-09-16Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 1000 MHz, D2O, predicted)2021-09-16Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 1000 MHz, D2O, predicted)2021-09-16Wishart LabView Spectrum
Biological Properties
Cellular Locations
  • Cytoplasm
  • Extracellular
  • Mitochondria
  • Lysosome
Biospecimen LocationsNot Available
Tissue LocationsNot Available
Pathways
Normal Concentrations
Not Available
Abnormal Concentrations
Not Available
Associated Disorders and Diseases
Disease ReferencesNone
Associated OMIM IDsNone
DrugBank IDNot Available
Phenol Explorer Compound IDNot Available
FooDB IDFDB023935
KNApSAcK IDNot Available
Chemspider ID147665
KEGG Compound IDC03204
BioCyc IDNot Available
BiGG ID2304175
Wikipedia LinkNot Available
METLIN IDNot Available
PubChem Compound168809
PDB IDNot Available
ChEBI ID15634
Food Biomarker OntologyNot Available
VMH IDNot Available
MarkerDB IDNot Available
Good Scents IDNot Available
References
Synthesis ReferenceNot Available
Material Safety Data Sheet (MSDS)Not Available
General References
  1. Baram J, Chabner BA, Drake JC, Fitzhugh AL, Sholar PW, Allegra CJ: Identification and biochemical properties of 10-formyldihydrofolate, a novel folate found in methotrexate-treated cells. J Biol Chem. 1988 May 25;263(15):7105-11. [PubMed:3366769 ]