Hmdb loader

Showing metabocard for Eriojaposide A (HMDB0038028)

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Record Information
Version5.0
StatusExpected but not Quantified
Creation Date2012-09-11 23:18:35 UTC
Update Date2022-03-07 02:55:36 UTC
HMDB IDHMDB0038028
Secondary Accession Numbers
  • HMDB38028
Metabolite Identification
Common NameEriojaposide A
DescriptionEriojaposide A belongs to the class of organic compounds known as fatty acyl glycosides of mono- and disaccharides. Fatty acyl glycosides of mono- and disaccharides are compounds composed of a mono- or disaccharide moiety linked to one hydroxyl group of a fatty alcohol or of a phosphorylated alcohol (phosphoprenols), a hydroxy fatty acid or to one carboxyl group of a fatty acid (ester linkage) or to an amino alcohol. Based on a literature review a small amount of articles have been published on Eriojaposide A.
Structure
Data?1563863129
MOL3D MOLSDF3D SDFPDB3D PDBSMILESInChI

MOL for HMDB0038028 (Eriojaposide A)


  Mrv0541 02241208422D          

 35 37  0  0  0  0            999 V2000
   -3.5702   -2.4743    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5702   -3.2974    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8556   -3.7097    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1424   -3.2988    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4278   -3.7111    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2848   -3.7111    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1410   -2.4743    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4278   -2.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7132   -2.4729    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0001   -2.0620    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.4277   -1.2360    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    2.1423    0.0007    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8556    0.4116    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1423   -3.2988    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    3.5702    1.6497    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2848    1.2374    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.2848    2.8866    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8569    3.7111    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 24  1  0  0  0  0
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 31 34  1  0  0  0  0
 32 33  1  0  0  0  0
M  END
Download

3D MOL for HMDB0038028 (Eriojaposide A)

HMDB0038028
     RDKit          3D
Eriojaposide A
 73 75  0  0  0  0  0  0  0  0999 V2000
   -4.1189   -2.2687    1.2566 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4612   -1.1658    2.0411 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0306   -0.9531    3.2380 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5389    0.0655    4.1460 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0767    0.4047    5.2242 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2608    0.8032    3.7837 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3907    1.0122    2.2923 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7077    1.6573    2.0130 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2332    1.8079    1.7422 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3173   -0.3902    1.6359 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0058   -0.2173    0.2204 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6006   -0.5983   -0.8688 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.3333    0.8612   -2.1846 O   0  0  0  0  0  0  0  0  0  0  0  0
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    2.5718   -0.5488   -2.1392 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.8636   -1.6282    1.4701 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.6787   -0.3762    4.4265 H   0  0  0  0  0  0  0  0  0  0  0  0
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    1.4784   -2.1977    1.5614 H   0  0  0  0  0  0  0  0  0  0  0  0
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 35 73  1  0
M  END
Download

3D SDF for HMDB0038028 (Eriojaposide A)


  Mrv0541 02241208422D          

 35 37  0  0  0  0            999 V2000
   -3.5702   -2.4743    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5702   -3.2974    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8556   -3.7097    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1424   -3.2988    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4278   -3.7111    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2848   -3.7111    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1410   -2.4743    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4278   -2.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7132   -2.4729    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0001   -2.0620    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0001   -1.2360    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7130   -2.4743    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4277   -2.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4277   -1.2360    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    2.1423    0.0007    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.8569    2.8852    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5702    2.4729    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5702    1.6497    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2848    1.2374    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.2848    2.8866    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8569    3.7111    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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 24 25  1  0  0  0  0
 27 28  1  0  0  0  0
 27 32  1  0  0  0  0
 28 29  1  0  0  0  0
 29 30  1  0  0  0  0
 30 31  1  0  0  0  0
 30 35  1  0  0  0  0
 31 32  1  0  0  0  0
 31 34  1  0  0  0  0
 32 33  1  0  0  0  0
M  END
> <DATABASE_ID>
HMDB0038028

> <DATABASE_NAME>
hmdb

> <SMILES>
CC(OC1OC(COC2OCC(O)C(O)C2O)C(O)C(O)C1O)\C=C\C1C(C)=CC(=O)CC1(C)C

> <INCHI_IDENTIFIER>
InChI=1S/C24H38O11/c1-11-7-13(25)8-24(3,4)14(11)6-5-12(2)34-23-21(31)19(29)18(28)16(35-23)10-33-22-20(30)17(27)15(26)9-32-22/h5-7,12,14-23,26-31H,8-10H2,1-4H3/b6-5+

> <INCHI_KEY>
FFYPJOJFUJFYAT-AATRIKPKSA-N

> <FORMULA>
C24H38O11

> <MOLECULAR_WEIGHT>
502.5519

> <EXACT_MASS>
502.241412058

> <JCHEM_ACCEPTOR_COUNT>
11

> <JCHEM_AVERAGE_POLARIZABILITY>
52.14317578361717

> <JCHEM_BIOAVAILABILITY>
0

> <JCHEM_DONOR_COUNT>
6

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
3,5,5-trimethyl-4-[(1E)-3-[(3,4,5-trihydroxy-6-{[(3,4,5-trihydroxyoxan-2-yl)oxy]methyl}oxan-2-yl)oxy]but-1-en-1-yl]cyclohex-2-en-1-one

> <ALOGPS_LOGP>
-0.77

> <JCHEM_LOGP>
-0.644852469333333

> <ALOGPS_LOGS>
-2.37

> <JCHEM_MDDR_LIKE_RULE>
1

> <JCHEM_NUMBER_OF_RINGS>
3

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA>
12.461748038893102

> <JCHEM_PKA_STRONGEST_ACIDIC>
11.927856523372695

> <JCHEM_PKA_STRONGEST_BASIC>
-3.526580404084756

> <JCHEM_POLAR_SURFACE_AREA>
175.37

> <JCHEM_REFRACTIVITY>
122.57119999999999

> <JCHEM_ROTATABLE_BOND_COUNT>
7

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
2.14e+00 g/l

> <JCHEM_TRADITIONAL_IUPAC>
3,5,5-trimethyl-4-[(1E)-3-[(3,4,5-trihydroxy-6-{[(3,4,5-trihydroxyoxan-2-yl)oxy]methyl}oxan-2-yl)oxy]but-1-en-1-yl]cyclohex-2-en-1-one

> <JCHEM_VEBER_RULE>
0

$$$$
Download

3D-SDF for HMDB0038028 (Eriojaposide A)

HMDB0038028
     RDKit          3D
Eriojaposide A
 73 75  0  0  0  0  0  0  0  0999 V2000
   -4.1189   -2.2687    1.2566 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4612   -1.1658    2.0411 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0306   -0.9531    3.2380 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5389    0.0655    4.1460 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0767    0.4047    5.2242 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2608    0.8032    3.7837 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3907    1.0122    2.2923 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7077    1.6573    2.0130 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2332    1.8079    1.7422 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3173   -0.3902    1.6359 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0058   -0.2173    0.2204 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6006   -0.5983   -0.8688 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0523   -0.2825   -2.2439 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3194   -0.1112   -3.1156 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3333    0.8612   -2.1846 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0385    0.8092   -2.6670 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8764    1.1014   -1.6826 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1919    0.8847   -2.0302 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5718   -0.5488   -2.1392 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4241   -1.3155   -1.0197 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.1877   -0.8860    0.0589 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0719   -1.9109    0.3607 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8636   -1.6282    1.4701 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9314   -1.6551    2.6646 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6235   -1.6528    3.8685 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0309   -0.4517    2.5265 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1296   -0.4886    3.5895 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3173   -0.4945    1.2221 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1848   -1.2771    1.3508 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5251    1.5330   -3.3819 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7497    2.1938   -3.3326 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4025    2.4937   -3.6876 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6286    3.2116   -4.8502 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.1496    1.6663   -3.9025 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3706    0.8952   -5.0440 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4250   -2.8680    0.6705 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0377   -1.9370    0.7516 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5166   -3.0182    2.0270 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8857   -1.5538    3.5471 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3927    0.1240    3.9476 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2027    1.7493    4.3186 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1049    1.3771    0.9972 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5085    1.4105    2.7364 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6050    2.7670    1.9738 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4931    2.1814    0.7466 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2948    1.2275    1.6656 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0255    2.7144    2.3571 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4118   -0.8484    2.1552 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0541    0.3577    0.0315 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5228   -1.1372   -0.7773 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5801   -1.1784   -2.6234 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1374   -0.4719   -4.1469 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1647   -0.6884   -2.7085 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6196    0.9566   -3.1362 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1419   -0.2347   -2.9984 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8165    1.4264   -1.3037 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0744   -1.0652   -2.9818 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6691   -0.5699   -2.4074 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7662   -0.0025   -0.2675 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3075   -0.6245    1.2977 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.6284   -2.4267    1.5237 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2783   -2.5519    2.5678 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4344   -1.0715    3.7097 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6806    0.4542    2.5912 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6787   -0.3762    4.4265 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9528    0.5464    1.0024 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4784   -2.1977    1.5614 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5769    0.7964   -4.1973 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0015    2.4035   -4.2623 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3172    3.1745   -2.8192 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9680    3.0026   -5.5697 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7427    2.2877   -4.1175 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2093   -0.0813   -4.8436 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
  4  6  1  0
  6  7  1  0
  7  8  1  0
  7  9  1  0
  7 10  1  0
 10 11  1  0
 11 12  2  0
 12 13  1  0
 13 14  1  0
 13 15  1  0
 15 16  1  0
 16 17  1  0
 17 18  1  0
 18 19  1  0
 19 20  1  0
 20 21  1  0
 21 22  1  0
 22 23  1  0
 23 24  1  0
 24 25  1  0
 24 26  1  0
 26 27  1  0
 26 28  1  0
 28 29  1  0
 18 30  1  0
 30 31  1  0
 30 32  1  0
 32 33  1  0
 32 34  1  0
 34 35  1  0
 10  2  1  0
 34 16  1  0
 28 21  1  0
  1 36  1  0
  1 37  1  0
  1 38  1  0
  3 39  1  0
  6 40  1  0
  6 41  1  0
  8 42  1  0
  8 43  1  0
  8 44  1  0
  9 45  1  0
  9 46  1  0
  9 47  1  0
 10 48  1  0
 11 49  1  0
 12 50  1  0
 13 51  1  0
 14 52  1  0
 14 53  1  0
 14 54  1  0
 16 55  1  0
 18 56  1  0
 19 57  1  0
 19 58  1  0
 21 59  1  0
 23 60  1  0
 23 61  1  0
 24 62  1  0
 25 63  1  0
 26 64  1  0
 27 65  1  0
 28 66  1  0
 29 67  1  0
 30 68  1  0
 31 69  1  0
 32 70  1  0
 33 71  1  0
 34 72  1  0
 35 73  1  0
M  END
Download

PDB for HMDB0038028 (Eriojaposide A)

HEADER    PROTEIN                                 24-FEB-12   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   24-FEB-12         0                                  
HETATM    1  C   UNK     0      -6.664  -4.619   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0      -6.664  -6.155   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0      -5.330  -6.925   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0      -3.999  -6.158   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0      -2.665  -6.927   0.000  0.00  0.00           C+0
HETATM    6  O   UNK     0      -7.998  -6.927   0.000  0.00  0.00           O+0
HETATM    7  C   UNK     0      -3.997  -4.619   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0      -2.665  -3.846   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0      -1.331  -4.616   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0      -0.000  -3.849   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0      -0.000  -2.307   0.000  0.00  0.00           C+0
HETATM   12  O   UNK     0       1.331  -4.619   0.000  0.00  0.00           O+0
HETATM   13  C   UNK     0       2.665  -3.846   0.000  0.00  0.00           C+0
HETATM   14  O   UNK     0       2.665  -2.307   0.000  0.00  0.00           O+0
HETATM   15  C   UNK     0       3.999  -1.540   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0       3.999   0.001   0.000  0.00  0.00           C+0
HETATM   17  O   UNK     0       5.330   0.768   0.000  0.00  0.00           O+0
HETATM   18  O   UNK     0       3.999  -6.158   0.000  0.00  0.00           O+0
HETATM   19  C   UNK     0       3.999  -4.616   0.000  0.00  0.00           C+0
HETATM   20  C   UNK     0       5.333  -3.846   0.000  0.00  0.00           C+0
HETATM   21  C   UNK     0       5.333  -2.310   0.000  0.00  0.00           C+0
HETATM   22  O   UNK     0       6.667  -1.538   0.000  0.00  0.00           O+0
HETATM   23  C   UNK     0      -6.321  -2.669   0.000  0.00  0.00           C+0
HETATM   24  C   UNK     0      -5.330  -3.849   0.000  0.00  0.00           C+0
HETATM   25  C   UNK     0      -4.343  -2.669   0.000  0.00  0.00           C+0
HETATM   26  O   UNK     0       6.664  -4.616   0.000  0.00  0.00           O+0
HETATM   27  C   UNK     0       5.330   2.310   0.000  0.00  0.00           C+0
HETATM   28  O   UNK     0       3.999   3.079   0.000  0.00  0.00           O+0
HETATM   29  C   UNK     0       3.999   4.619   0.000  0.00  0.00           C+0
HETATM   30  C   UNK     0       5.333   5.386   0.000  0.00  0.00           C+0
HETATM   31  C   UNK     0       6.664   4.616   0.000  0.00  0.00           C+0
HETATM   32  C   UNK     0       6.664   3.079   0.000  0.00  0.00           C+0
HETATM   33  O   UNK     0       7.998   2.310   0.000  0.00  0.00           O+0
HETATM   34  O   UNK     0       7.998   5.388   0.000  0.00  0.00           O+0
HETATM   35  O   UNK     0       5.333   6.927   0.000  0.00  0.00           O+0
CONECT    1    2   24                                                       
CONECT    2    1    3    6                                                  
CONECT    3    2    4                                                       
CONECT    4    3    5    7                                                  
CONECT    5    4                                                            
CONECT    6    2                                                            
CONECT    7    4    8   24                                                  
CONECT    8    7    9                                                       
CONECT    9    8   10                                                       
CONECT   10    9   11   12                                                  
CONECT   11   10                                                            
CONECT   12   10   13                                                       
CONECT   13   12   14   19                                                  
CONECT   14   13   15                                                       
CONECT   15   14   16   21                                                  
CONECT   16   15   17                                                       
CONECT   17   16   27                                                       
CONECT   18   19                                                            
CONECT   19   13   18   20                                                  
CONECT   20   19   21   26                                                  
CONECT   21   15   20   22                                                  
CONECT   22   21                                                            
CONECT   23   24                                                            
CONECT   24    1    7   23   25                                             
CONECT   25   24                                                            
CONECT   26   20                                                            
CONECT   27   17   28   32                                                  
CONECT   28   27   29                                                       
CONECT   29   28   30                                                       
CONECT   30   29   31   35                                                  
CONECT   31   30   32   34                                                  
CONECT   32   27   31   33                                                  
CONECT   33   32                                                            
CONECT   34   31                                                            
CONECT   35   30                                                            
MASTER        0    0    0    0    0    0    0    0   35    0   74    0
END
Download

3D PDB for HMDB0038028 (Eriojaposide A)

COMPND    HMDB0038028
HETATM    1  C1  UNL     1      -4.119  -2.269   1.257  1.00  0.00           C  
HETATM    2  C2  UNL     1      -3.461  -1.166   2.041  1.00  0.00           C  
HETATM    3  C3  UNL     1      -4.031  -0.953   3.238  1.00  0.00           C  
HETATM    4  C4  UNL     1      -3.539   0.065   4.146  1.00  0.00           C  
HETATM    5  O1  UNL     1      -4.077   0.405   5.224  1.00  0.00           O  
HETATM    6  C5  UNL     1      -2.261   0.803   3.784  1.00  0.00           C  
HETATM    7  C6  UNL     1      -2.391   1.012   2.292  1.00  0.00           C  
HETATM    8  C7  UNL     1      -3.708   1.657   2.013  1.00  0.00           C  
HETATM    9  C8  UNL     1      -1.233   1.808   1.742  1.00  0.00           C  
HETATM   10  C9  UNL     1      -2.317  -0.390   1.636  1.00  0.00           C  
HETATM   11  C10 UNL     1      -2.006  -0.217   0.220  1.00  0.00           C  
HETATM   12  C11 UNL     1      -2.601  -0.598  -0.869  1.00  0.00           C  
HETATM   13  C12 UNL     1      -2.052  -0.282  -2.244  1.00  0.00           C  
HETATM   14  C13 UNL     1      -3.319  -0.111  -3.116  1.00  0.00           C  
HETATM   15  O2  UNL     1      -1.333   0.861  -2.185  1.00  0.00           O  
HETATM   16  C14 UNL     1      -0.038   0.809  -2.667  1.00  0.00           C  
HETATM   17  O3  UNL     1       0.876   1.101  -1.683  1.00  0.00           O  
HETATM   18  C15 UNL     1       2.192   0.885  -2.030  1.00  0.00           C  
HETATM   19  C16 UNL     1       2.572  -0.549  -2.139  1.00  0.00           C  
HETATM   20  O4  UNL     1       2.424  -1.316  -1.020  1.00  0.00           O  
HETATM   21  C17 UNL     1       3.188  -0.886   0.059  1.00  0.00           C  
HETATM   22  O5  UNL     1       4.072  -1.911   0.361  1.00  0.00           O  
HETATM   23  C18 UNL     1       4.864  -1.628   1.470  1.00  0.00           C  
HETATM   24  C19 UNL     1       3.931  -1.655   2.665  1.00  0.00           C  
HETATM   25  O6  UNL     1       4.624  -1.653   3.868  1.00  0.00           O  
HETATM   26  C20 UNL     1       3.031  -0.452   2.527  1.00  0.00           C  
HETATM   27  O7  UNL     1       2.130  -0.489   3.590  1.00  0.00           O  
HETATM   28  C21 UNL     1       2.317  -0.495   1.222  1.00  0.00           C  
HETATM   29  O8  UNL     1       1.185  -1.277   1.351  1.00  0.00           O  
HETATM   30  C22 UNL     1       2.525   1.533  -3.382  1.00  0.00           C  
HETATM   31  O9  UNL     1       3.750   2.194  -3.333  1.00  0.00           O  
HETATM   32  C23 UNL     1       1.402   2.494  -3.688  1.00  0.00           C  
HETATM   33  O10 UNL     1       1.629   3.212  -4.850  1.00  0.00           O  
HETATM   34  C24 UNL     1       0.150   1.666  -3.902  1.00  0.00           C  
HETATM   35  O11 UNL     1       0.371   0.895  -5.044  1.00  0.00           O  
HETATM   36  H1  UNL     1      -3.425  -2.868   0.671  1.00  0.00           H  
HETATM   37  H2  UNL     1      -5.038  -1.937   0.752  1.00  0.00           H  
HETATM   38  H3  UNL     1      -4.517  -3.018   2.027  1.00  0.00           H  
HETATM   39  H4  UNL     1      -4.886  -1.554   3.547  1.00  0.00           H  
HETATM   40  H5  UNL     1      -1.393   0.124   3.948  1.00  0.00           H  
HETATM   41  H6  UNL     1      -2.203   1.749   4.319  1.00  0.00           H  
HETATM   42  H7  UNL     1      -4.105   1.377   0.997  1.00  0.00           H  
HETATM   43  H8  UNL     1      -4.508   1.411   2.736  1.00  0.00           H  
HETATM   44  H9  UNL     1      -3.605   2.767   1.974  1.00  0.00           H  
HETATM   45  H10 UNL     1      -1.493   2.181   0.747  1.00  0.00           H  
HETATM   46  H11 UNL     1      -0.295   1.228   1.666  1.00  0.00           H  
HETATM   47  H12 UNL     1      -1.026   2.714   2.357  1.00  0.00           H  
HETATM   48  H13 UNL     1      -1.412  -0.848   2.155  1.00  0.00           H  
HETATM   49  H14 UNL     1      -1.054   0.358   0.031  1.00  0.00           H  
HETATM   50  H15 UNL     1      -3.523  -1.137  -0.777  1.00  0.00           H  
HETATM   51  H16 UNL     1      -1.580  -1.178  -2.623  1.00  0.00           H  
HETATM   52  H17 UNL     1      -3.137  -0.472  -4.147  1.00  0.00           H  
HETATM   53  H18 UNL     1      -4.165  -0.688  -2.708  1.00  0.00           H  
HETATM   54  H19 UNL     1      -3.620   0.957  -3.136  1.00  0.00           H  
HETATM   55  H20 UNL     1       0.142  -0.235  -2.998  1.00  0.00           H  
HETATM   56  H21 UNL     1       2.816   1.426  -1.304  1.00  0.00           H  
HETATM   57  H22 UNL     1       2.074  -1.065  -2.982  1.00  0.00           H  
HETATM   58  H23 UNL     1       3.669  -0.570  -2.407  1.00  0.00           H  
HETATM   59  H24 UNL     1       3.766  -0.002  -0.267  1.00  0.00           H  
HETATM   60  H25 UNL     1       5.307  -0.624   1.298  1.00  0.00           H  
HETATM   61  H26 UNL     1       5.628  -2.427   1.524  1.00  0.00           H  
HETATM   62  H27 UNL     1       3.278  -2.552   2.568  1.00  0.00           H  
HETATM   63  H28 UNL     1       5.434  -1.072   3.710  1.00  0.00           H  
HETATM   64  H29 UNL     1       3.681   0.454   2.591  1.00  0.00           H  
HETATM   65  H30 UNL     1       2.679  -0.376   4.426  1.00  0.00           H  
HETATM   66  H31 UNL     1       1.953   0.546   1.002  1.00  0.00           H  
HETATM   67  H32 UNL     1       1.478  -2.198   1.561  1.00  0.00           H  
HETATM   68  H33 UNL     1       2.577   0.796  -4.197  1.00  0.00           H  
HETATM   69  H34 UNL     1       4.001   2.403  -4.262  1.00  0.00           H  
HETATM   70  H35 UNL     1       1.317   3.175  -2.819  1.00  0.00           H  
HETATM   71  H36 UNL     1       0.968   3.003  -5.570  1.00  0.00           H  
HETATM   72  H37 UNL     1      -0.743   2.288  -4.117  1.00  0.00           H  
HETATM   73  H38 UNL     1       0.209  -0.081  -4.844  1.00  0.00           H  
CONECT    1    2   36   37   38
CONECT    2    3    3   10
CONECT    3    4   39
CONECT    4    5    5    6
CONECT    6    7   40   41
CONECT    7    8    9   10
CONECT    8   42   43   44
CONECT    9   45   46   47
CONECT   10   11   48
CONECT   11   12   12   49
CONECT   12   13   50
CONECT   13   14   15   51
CONECT   14   52   53   54
CONECT   15   16
CONECT   16   17   34   55
CONECT   17   18
CONECT   18   19   30   56
CONECT   19   20   57   58
CONECT   20   21
CONECT   21   22   28   59
CONECT   22   23
CONECT   23   24   60   61
CONECT   24   25   26   62
CONECT   25   63
CONECT   26   27   28   64
CONECT   27   65
CONECT   28   29   66
CONECT   29   67
CONECT   30   31   32   68
CONECT   31   69
CONECT   32   33   34   70
CONECT   33   71
CONECT   34   35   72
CONECT   35   73
END
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SMILES for HMDB0038028 (Eriojaposide A)

CC(OC1OC(COC2OCC(O)C(O)C2O)C(O)C(O)C1O)\C=C\C1C(C)=CC(=O)CC1(C)C
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INCHI for HMDB0038028 (Eriojaposide A)

InChI=1S/C24H38O11/c1-11-7-13(25)8-24(3,4)14(11)6-5-12(2)34-23-21(31)19(29)18(28)16(35-23)10-33-22-20(30)17(27)15(26)9-32-22/h5-7,12,14-23,26-31H,8-10H2,1-4H3/b6-5+
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View in JSmolView NMR AssignmentsView Stereo Labels
Synonyms
ValueSource
(6R,9R)-3-oxo-alpha-Ionyl-9-O-beta-xylopyranosyl-(1''-6')-beta-glucopyranosideMeSH
Eriojaposide aMeSH
Chemical FormulaC24H38O11
Average Molecular Weight502.5519
Monoisotopic Molecular Weight502.241412058
IUPAC Name3,5,5-trimethyl-4-[(1E)-3-[(3,4,5-trihydroxy-6-{[(3,4,5-trihydroxyoxan-2-yl)oxy]methyl}oxan-2-yl)oxy]but-1-en-1-yl]cyclohex-2-en-1-one
Traditional Name3,5,5-trimethyl-4-[(1E)-3-[(3,4,5-trihydroxy-6-{[(3,4,5-trihydroxyoxan-2-yl)oxy]methyl}oxan-2-yl)oxy]but-1-en-1-yl]cyclohex-2-en-1-one
CAS Registry Number290308-51-9
SMILES
CC(OC1OC(COC2OCC(O)C(O)C2O)C(O)C(O)C1O)\C=C\C1C(C)=CC(=O)CC1(C)C
InChI Identifier
InChI=1S/C24H38O11/c1-11-7-13(25)8-24(3,4)14(11)6-5-12(2)34-23-21(31)19(29)18(28)16(35-23)10-33-22-20(30)17(27)15(26)9-32-22/h5-7,12,14-23,26-31H,8-10H2,1-4H3/b6-5+
InChI KeyFFYPJOJFUJFYAT-AATRIKPKSA-N
Chemical Taxonomy
Description Belongs to the class of organic compounds known as fatty acyl glycosides of mono- and disaccharides. Fatty acyl glycosides of mono- and disaccharides are compounds composed of a mono- or disaccharide moiety linked to one hydroxyl group of a fatty alcohol or of a phosphorylated alcohol (phosphoprenols), a hydroxy fatty acid or to one carboxyl group of a fatty acid (ester linkage) or to an amino alcohol.
KingdomOrganic compounds
Super ClassLipids and lipid-like molecules
ClassFatty Acyls
Sub ClassFatty acyl glycosides
Direct ParentFatty acyl glycosides of mono- and disaccharides
Alternative Parents
Substituents
  • Fatty acyl glycoside of mono- or disaccharide
  • Cyclofarsesane sesquiterpenoid
  • Megastigmane sesquiterpenoid
  • Sesquiterpenoid
  • Ionone derivative
  • Alkyl glycoside
  • Disaccharide
  • Glycosyl compound
  • O-glycosyl compound
  • Cyclohexenone
  • Oxane
  • Ketone
  • Cyclic ketone
  • Secondary alcohol
  • Organoheterocyclic compound
  • Acetal
  • Oxacycle
  • Polyol
  • Organooxygen compound
  • Hydrocarbon derivative
  • Organic oxide
  • Carbonyl group
  • Organic oxygen compound
  • Alcohol
  • Aliphatic heteromonocyclic compound
Molecular FrameworkAliphatic heteromonocyclic compounds
External DescriptorsNot Available
Ontology
Physiological effectNot Available
Disposition
Biological locationRoute of exposureSource
Process
Naturally occurring process
Role
Biological roleIndustrial application
Physical Properties
StateNot Available
Experimental Molecular Properties
PropertyValueReference
Melting PointNot AvailableNot Available
Boiling PointNot AvailableNot Available
Water Solubility402.8 mg/L @ 25 °C (est)The Good Scents Company Information System
LogPNot AvailableNot Available
Experimental Chromatographic PropertiesNot Available
Predicted Molecular Properties
PropertyValueSource
Water Solubility2.14 g/LALOGPS
logP-0.77ALOGPS
logP-0.64ChemAxon
logS-2.4ALOGPS
pKa (Strongest Acidic)11.93ChemAxon
pKa (Strongest Basic)-3.5ChemAxon
Physiological Charge0ChemAxon
Hydrogen Acceptor Count11ChemAxon
Hydrogen Donor Count6ChemAxon
Polar Surface Area175.37 ŲChemAxon
Rotatable Bond Count7ChemAxon
Refractivity122.57 m³·mol⁻¹ChemAxon
Polarizability52.14 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]+213.8431661259
DarkChem[M-H]-209.09931661259
DeepCCS[M+H]+216.11630932474
DeepCCS[M-H]-213.7230932474
DeepCCS[M-2H]-246.60430932474
DeepCCS[M+Na]+222.03930932474
AllCCS[M+H]+221.932859911
AllCCS[M+H-H2O]+220.232859911
AllCCS[M+NH4]+223.432859911
AllCCS[M+Na]+223.832859911
AllCCS[M-H]-211.132859911
AllCCS[M+Na-2H]-213.032859911
AllCCS[M+HCOO]-215.332859911

Predicted Kovats Retention Indices

Underivatized

MetaboliteSMILESKovats RI ValueColumn TypeReference
Eriojaposide ACC(OC1OC(COC2OCC(O)C(O)C2O)C(O)C(O)C1O)\C=C\C1C(C)=CC(=O)CC1(C)C4810.5Standard polar33892256
Eriojaposide ACC(OC1OC(COC2OCC(O)C(O)C2O)C(O)C(O)C1O)\C=C\C1C(C)=CC(=O)CC1(C)C3607.6Standard non polar33892256
Eriojaposide ACC(OC1OC(COC2OCC(O)C(O)C2O)C(O)C(O)C1O)\C=C\C1C(C)=CC(=O)CC1(C)C3886.8Semi standard non polar33892256

Derivatized

Derivative Name / StructureSMILESKovats RI ValueColumn TypeReference
Eriojaposide A,1TMS,isomer #1CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C)C(O)C2O)C(O)C(O)C1O3934.4Semi standard non polar33892256
Eriojaposide A,1TMS,isomer #2CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O[Si](C)(C)C)C2O)C(O)C(O)C1O3891.0Semi standard non polar33892256
Eriojaposide A,1TMS,isomer #3CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O)C2O[Si](C)(C)C)C(O)C(O)C1O3902.2Semi standard non polar33892256
Eriojaposide A,1TMS,isomer #4CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O)C2O)C(O[Si](C)(C)C)C(O)C1O3931.2Semi standard non polar33892256
Eriojaposide A,1TMS,isomer #5CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O)C2O)C(O)C(O[Si](C)(C)C)C1O3909.3Semi standard non polar33892256
Eriojaposide A,1TMS,isomer #6CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O)C2O)C(O)C(O)C1O[Si](C)(C)C3919.4Semi standard non polar33892256
Eriojaposide A,1TMS,isomer #7CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O)C2O)C(O)C(O)C1O3872.9Semi standard non polar33892256
Eriojaposide A,2TMS,isomer #1CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O)C(O)C1O3835.8Semi standard non polar33892256
Eriojaposide A,2TMS,isomer #10CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O[Si](C)(C)C)C2O)C(O)C(O)C1O[Si](C)(C)C3801.1Semi standard non polar33892256
Eriojaposide A,2TMS,isomer #11CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O[Si](C)(C)C)C2O)C(O)C(O)C1O3741.6Semi standard non polar33892256
Eriojaposide A,2TMS,isomer #12CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O3844.8Semi standard non polar33892256
Eriojaposide A,2TMS,isomer #13CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O3800.2Semi standard non polar33892256
Eriojaposide A,2TMS,isomer #14CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O)C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C3830.7Semi standard non polar33892256
Eriojaposide A,2TMS,isomer #15CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O)C2O[Si](C)(C)C)C(O)C(O)C1O3789.6Semi standard non polar33892256
Eriojaposide A,2TMS,isomer #16CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O3852.2Semi standard non polar33892256
Eriojaposide A,2TMS,isomer #17CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O)C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C3853.8Semi standard non polar33892256
Eriojaposide A,2TMS,isomer #18CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O)C2O)C(O[Si](C)(C)C)C(O)C1O3819.1Semi standard non polar33892256
Eriojaposide A,2TMS,isomer #19CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O)C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C3862.0Semi standard non polar33892256
Eriojaposide A,2TMS,isomer #2CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C(O)C(O)C1O3834.9Semi standard non polar33892256
Eriojaposide A,2TMS,isomer #20CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O)C2O)C(O)C(O[Si](C)(C)C)C1O3763.9Semi standard non polar33892256
Eriojaposide A,2TMS,isomer #21CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O)C2O)C(O)C(O)C1O[Si](C)(C)C3813.6Semi standard non polar33892256
Eriojaposide A,2TMS,isomer #3CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C)C(O)C2O)C(O[Si](C)(C)C)C(O)C1O3868.9Semi standard non polar33892256
Eriojaposide A,2TMS,isomer #4CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C)C(O)C2O)C(O)C(O[Si](C)(C)C)C1O3830.0Semi standard non polar33892256
Eriojaposide A,2TMS,isomer #5CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C)C(O)C2O)C(O)C(O)C1O[Si](C)(C)C3852.9Semi standard non polar33892256
Eriojaposide A,2TMS,isomer #6CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C)C(O)C2O)C(O)C(O)C1O3804.5Semi standard non polar33892256
Eriojaposide A,2TMS,isomer #7CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O3811.8Semi standard non polar33892256
Eriojaposide A,2TMS,isomer #8CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O3818.7Semi standard non polar33892256
Eriojaposide A,2TMS,isomer #9CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O3787.8Semi standard non polar33892256
Eriojaposide A,3TMS,isomer #1CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O3777.2Semi standard non polar33892256
Eriojaposide A,3TMS,isomer #10CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C)C(O)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O3717.6Semi standard non polar33892256
Eriojaposide A,3TMS,isomer #11CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C)C(O)C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C3723.5Semi standard non polar33892256
Eriojaposide A,3TMS,isomer #12CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C)C(O)C2O)C(O[Si](C)(C)C)C(O)C1O3722.1Semi standard non polar33892256
Eriojaposide A,3TMS,isomer #13CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C)C(O)C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C3724.4Semi standard non polar33892256
Eriojaposide A,3TMS,isomer #14CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C)C(O)C2O)C(O)C(O[Si](C)(C)C)C1O3655.9Semi standard non polar33892256
Eriojaposide A,3TMS,isomer #15CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C)C(O)C2O)C(O)C(O)C1O[Si](C)(C)C3723.9Semi standard non polar33892256
Eriojaposide A,3TMS,isomer #16CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O3699.4Semi standard non polar33892256
Eriojaposide A,3TMS,isomer #17CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O3661.9Semi standard non polar33892256
Eriojaposide A,3TMS,isomer #18CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C3682.0Semi standard non polar33892256
Eriojaposide A,3TMS,isomer #19CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O3649.6Semi standard non polar33892256
Eriojaposide A,3TMS,isomer #2CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O3717.0Semi standard non polar33892256
Eriojaposide A,3TMS,isomer #20CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O3665.6Semi standard non polar33892256
Eriojaposide A,3TMS,isomer #21CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C3670.0Semi standard non polar33892256
Eriojaposide A,3TMS,isomer #22CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O3648.2Semi standard non polar33892256
Eriojaposide A,3TMS,isomer #23CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C3672.4Semi standard non polar33892256
Eriojaposide A,3TMS,isomer #24CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O3593.3Semi standard non polar33892256
Eriojaposide A,3TMS,isomer #25CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O[Si](C)(C)C)C2O)C(O)C(O)C1O[Si](C)(C)C3648.3Semi standard non polar33892256
Eriojaposide A,3TMS,isomer #26CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O3690.4Semi standard non polar33892256
Eriojaposide A,3TMS,isomer #27CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C3701.6Semi standard non polar33892256
Eriojaposide A,3TMS,isomer #28CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O3722.0Semi standard non polar33892256
Eriojaposide A,3TMS,isomer #29CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C3698.8Semi standard non polar33892256
Eriojaposide A,3TMS,isomer #3CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O3678.9Semi standard non polar33892256
Eriojaposide A,3TMS,isomer #30CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O3650.4Semi standard non polar33892256
Eriojaposide A,3TMS,isomer #31CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O)C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C3719.9Semi standard non polar33892256
Eriojaposide A,3TMS,isomer #32CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C3754.8Semi standard non polar33892256
Eriojaposide A,3TMS,isomer #33CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O3677.2Semi standard non polar33892256
Eriojaposide A,3TMS,isomer #34CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O)C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C3698.1Semi standard non polar33892256
Eriojaposide A,3TMS,isomer #35CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O)C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C3693.9Semi standard non polar33892256
Eriojaposide A,3TMS,isomer #4CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O)C(O)C1O[Si](C)(C)C3697.8Semi standard non polar33892256
Eriojaposide A,3TMS,isomer #5CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O)C(O)C1O3668.9Semi standard non polar33892256
Eriojaposide A,3TMS,isomer #6CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O3742.8Semi standard non polar33892256
Eriojaposide A,3TMS,isomer #7CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O3695.5Semi standard non polar33892256
Eriojaposide A,3TMS,isomer #8CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C3724.7Semi standard non polar33892256
Eriojaposide A,3TMS,isomer #9CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C(O)C(O)C1O3690.6Semi standard non polar33892256
Eriojaposide A,4TMS,isomer #1CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O3710.5Semi standard non polar33892256
Eriojaposide A,4TMS,isomer #10CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O)C(O)C1O[Si](C)(C)C3581.1Semi standard non polar33892256
Eriojaposide A,4TMS,isomer #11CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O3663.5Semi standard non polar33892256
Eriojaposide A,4TMS,isomer #12CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C3666.0Semi standard non polar33892256
Eriojaposide A,4TMS,isomer #13CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O3632.6Semi standard non polar33892256
Eriojaposide A,4TMS,isomer #14CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C3664.5Semi standard non polar33892256
Eriojaposide A,4TMS,isomer #15CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O3578.5Semi standard non polar33892256
Eriojaposide A,4TMS,isomer #16CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C3627.2Semi standard non polar33892256
Eriojaposide A,4TMS,isomer #17CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C)C(O)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C3662.6Semi standard non polar33892256
Eriojaposide A,4TMS,isomer #18CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C)C(O)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O3586.0Semi standard non polar33892256
Eriojaposide A,4TMS,isomer #19CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C)C(O)C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C3605.1Semi standard non polar33892256
Eriojaposide A,4TMS,isomer #2CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O3664.2Semi standard non polar33892256
Eriojaposide A,4TMS,isomer #20CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C)C(O)C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C3590.5Semi standard non polar33892256
Eriojaposide A,4TMS,isomer #21CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O3619.4Semi standard non polar33892256
Eriojaposide A,4TMS,isomer #22CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C3622.5Semi standard non polar33892256
Eriojaposide A,4TMS,isomer #23CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O3588.0Semi standard non polar33892256
Eriojaposide A,4TMS,isomer #24CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C3617.6Semi standard non polar33892256
Eriojaposide A,4TMS,isomer #25CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O3540.1Semi standard non polar33892256
Eriojaposide A,4TMS,isomer #26CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C3583.7Semi standard non polar33892256
Eriojaposide A,4TMS,isomer #27CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C3608.9Semi standard non polar33892256
Eriojaposide A,4TMS,isomer #28CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O3531.3Semi standard non polar33892256
Eriojaposide A,4TMS,isomer #29CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C3544.5Semi standard non polar33892256
Eriojaposide A,4TMS,isomer #3CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C3690.8Semi standard non polar33892256
Eriojaposide A,4TMS,isomer #30CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C3532.1Semi standard non polar33892256
Eriojaposide A,4TMS,isomer #31CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C3647.4Semi standard non polar33892256
Eriojaposide A,4TMS,isomer #32CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O3581.6Semi standard non polar33892256
Eriojaposide A,4TMS,isomer #33CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C3602.6Semi standard non polar33892256
Eriojaposide A,4TMS,isomer #34CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C3590.7Semi standard non polar33892256
Eriojaposide A,4TMS,isomer #35CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C3618.0Semi standard non polar33892256
Eriojaposide A,4TMS,isomer #4CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O3653.3Semi standard non polar33892256
Eriojaposide A,4TMS,isomer #5CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O3625.3Semi standard non polar33892256
Eriojaposide A,4TMS,isomer #6CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C3629.8Semi standard non polar33892256
Eriojaposide A,4TMS,isomer #7CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O3586.2Semi standard non polar33892256
Eriojaposide A,4TMS,isomer #8CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C3624.6Semi standard non polar33892256
Eriojaposide A,4TMS,isomer #9CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O3540.1Semi standard non polar33892256
Eriojaposide A,5TMS,isomer #1CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O3609.1Semi standard non polar33892256
Eriojaposide A,5TMS,isomer #10CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C3478.8Semi standard non polar33892256
Eriojaposide A,5TMS,isomer #11CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C3609.0Semi standard non polar33892256
Eriojaposide A,5TMS,isomer #12CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O3533.8Semi standard non polar33892256
Eriojaposide A,5TMS,isomer #13CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C3544.6Semi standard non polar33892256
Eriojaposide A,5TMS,isomer #14CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C3530.5Semi standard non polar33892256
Eriojaposide A,5TMS,isomer #15CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C)C(O)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C3540.7Semi standard non polar33892256
Eriojaposide A,5TMS,isomer #16CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C3560.7Semi standard non polar33892256
Eriojaposide A,5TMS,isomer #17CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O3486.3Semi standard non polar33892256
Eriojaposide A,5TMS,isomer #18CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C3495.2Semi standard non polar33892256
Eriojaposide A,5TMS,isomer #19CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C3482.2Semi standard non polar33892256
Eriojaposide A,5TMS,isomer #2CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C3607.2Semi standard non polar33892256
Eriojaposide A,5TMS,isomer #20CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C3458.2Semi standard non polar33892256
Eriojaposide A,5TMS,isomer #21CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C3530.3Semi standard non polar33892256
Eriojaposide A,5TMS,isomer #3CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O3584.9Semi standard non polar33892256
Eriojaposide A,5TMS,isomer #4CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C3598.0Semi standard non polar33892256
Eriojaposide A,5TMS,isomer #5CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O3525.3Semi standard non polar33892256
Eriojaposide A,5TMS,isomer #6CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C3566.5Semi standard non polar33892256
Eriojaposide A,5TMS,isomer #7CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C3557.8Semi standard non polar33892256
Eriojaposide A,5TMS,isomer #8CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O3482.7Semi standard non polar33892256
Eriojaposide A,5TMS,isomer #9CC1=CC(O[Si](C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C3490.8Semi standard non polar33892256
Eriojaposide A,1TBDMS,isomer #1CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C(C)(C)C)C(O)C2O)C(O)C(O)C1O4150.8Semi standard non polar33892256
Eriojaposide A,1TBDMS,isomer #2CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O[Si](C)(C)C(C)(C)C)C2O)C(O)C(O)C1O4097.3Semi standard non polar33892256
Eriojaposide A,1TBDMS,isomer #3CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O)C2O[Si](C)(C)C(C)(C)C)C(O)C(O)C1O4122.9Semi standard non polar33892256
Eriojaposide A,1TBDMS,isomer #4CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O)C2O)C(O[Si](C)(C)C(C)(C)C)C(O)C1O4146.9Semi standard non polar33892256
Eriojaposide A,1TBDMS,isomer #5CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O)C2O)C(O)C(O[Si](C)(C)C(C)(C)C)C1O4111.1Semi standard non polar33892256
Eriojaposide A,1TBDMS,isomer #6CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O)C2O)C(O)C(O)C1O[Si](C)(C)C(C)(C)C4138.2Semi standard non polar33892256
Eriojaposide A,1TBDMS,isomer #7CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O)C2O)C(O)C(O)C1O4079.8Semi standard non polar33892256
Eriojaposide A,2TBDMS,isomer #1CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C2O)C(O)C(O)C1O4240.1Semi standard non polar33892256
Eriojaposide A,2TBDMS,isomer #10CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O[Si](C)(C)C(C)(C)C)C2O)C(O)C(O)C1O[Si](C)(C)C(C)(C)C4209.5Semi standard non polar33892256
Eriojaposide A,2TBDMS,isomer #11CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O[Si](C)(C)C(C)(C)C)C2O)C(O)C(O)C1O4137.7Semi standard non polar33892256
Eriojaposide A,2TBDMS,isomer #12CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O)C2O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C(O)C1O4247.5Semi standard non polar33892256
Eriojaposide A,2TBDMS,isomer #13CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O)C2O[Si](C)(C)C(C)(C)C)C(O)C(O[Si](C)(C)C(C)(C)C)C1O4206.9Semi standard non polar33892256
Eriojaposide A,2TBDMS,isomer #14CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O)C2O[Si](C)(C)C(C)(C)C)C(O)C(O)C1O[Si](C)(C)C(C)(C)C4235.3Semi standard non polar33892256
Eriojaposide A,2TBDMS,isomer #15CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O)C2O[Si](C)(C)C(C)(C)C)C(O)C(O)C1O4188.1Semi standard non polar33892256
Eriojaposide A,2TBDMS,isomer #16CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O)C2O)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C1O4250.9Semi standard non polar33892256
Eriojaposide A,2TBDMS,isomer #17CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O)C2O)C(O[Si](C)(C)C(C)(C)C)C(O)C1O[Si](C)(C)C(C)(C)C4256.9Semi standard non polar33892256
Eriojaposide A,2TBDMS,isomer #18CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O)C2O)C(O[Si](C)(C)C(C)(C)C)C(O)C1O4206.1Semi standard non polar33892256
Eriojaposide A,2TBDMS,isomer #19CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O)C2O)C(O)C(O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C(C)(C)C4263.3Semi standard non polar33892256
Eriojaposide A,2TBDMS,isomer #2CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C(C)(C)C)C(O)C2O[Si](C)(C)C(C)(C)C)C(O)C(O)C1O4253.6Semi standard non polar33892256
Eriojaposide A,2TBDMS,isomer #20CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O)C2O)C(O)C(O[Si](C)(C)C(C)(C)C)C1O4158.9Semi standard non polar33892256
Eriojaposide A,2TBDMS,isomer #21CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O)C2O)C(O)C(O)C1O[Si](C)(C)C(C)(C)C4209.0Semi standard non polar33892256
Eriojaposide A,2TBDMS,isomer #3CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C(C)(C)C)C(O)C2O)C(O[Si](C)(C)C(C)(C)C)C(O)C1O4272.2Semi standard non polar33892256
Eriojaposide A,2TBDMS,isomer #4CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C(C)(C)C)C(O)C2O)C(O)C(O[Si](C)(C)C(C)(C)C)C1O4235.4Semi standard non polar33892256
Eriojaposide A,2TBDMS,isomer #5CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C(C)(C)C)C(O)C2O)C(O)C(O)C1O[Si](C)(C)C(C)(C)C4263.1Semi standard non polar33892256
Eriojaposide A,2TBDMS,isomer #6CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C(C)(C)C)C(O)C2O)C(O)C(O)C1O4204.2Semi standard non polar33892256
Eriojaposide A,2TBDMS,isomer #7CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O[Si](C)(C)C(C)(C)C)C2O[Si](C)(C)C(C)(C)C)C(O)C(O)C1O4235.4Semi standard non polar33892256
Eriojaposide A,2TBDMS,isomer #8CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O[Si](C)(C)C(C)(C)C)C2O)C(O[Si](C)(C)C(C)(C)C)C(O)C1O4220.2Semi standard non polar33892256
Eriojaposide A,2TBDMS,isomer #9CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O[Si](C)(C)C(C)(C)C)C2O)C(O)C(O[Si](C)(C)C(C)(C)C)C1O4178.3Semi standard non polar33892256
Eriojaposide A,3TBDMS,isomer #1CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C2O[Si](C)(C)C(C)(C)C)C(O)C(O)C1O4429.1Semi standard non polar33892256
Eriojaposide A,3TBDMS,isomer #10CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C(C)(C)C)C(O)C2O)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C1O4401.0Semi standard non polar33892256
Eriojaposide A,3TBDMS,isomer #11CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C(C)(C)C)C(O)C2O)C(O[Si](C)(C)C(C)(C)C)C(O)C1O[Si](C)(C)C(C)(C)C4396.2Semi standard non polar33892256
Eriojaposide A,3TBDMS,isomer #12CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C(C)(C)C)C(O)C2O)C(O[Si](C)(C)C(C)(C)C)C(O)C1O4303.3Semi standard non polar33892256
Eriojaposide A,3TBDMS,isomer #13CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C(C)(C)C)C(O)C2O)C(O)C(O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C(C)(C)C4398.8Semi standard non polar33892256
Eriojaposide A,3TBDMS,isomer #14CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C(C)(C)C)C(O)C2O)C(O)C(O[Si](C)(C)C(C)(C)C)C1O4262.1Semi standard non polar33892256
Eriojaposide A,3TBDMS,isomer #15CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C(C)(C)C)C(O)C2O)C(O)C(O)C1O[Si](C)(C)C(C)(C)C4302.5Semi standard non polar33892256
Eriojaposide A,3TBDMS,isomer #16CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O[Si](C)(C)C(C)(C)C)C2O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C(O)C1O4377.3Semi standard non polar33892256
Eriojaposide A,3TBDMS,isomer #17CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O[Si](C)(C)C(C)(C)C)C2O[Si](C)(C)C(C)(C)C)C(O)C(O[Si](C)(C)C(C)(C)C)C1O4353.7Semi standard non polar33892256
Eriojaposide A,3TBDMS,isomer #18CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O[Si](C)(C)C(C)(C)C)C2O[Si](C)(C)C(C)(C)C)C(O)C(O)C1O[Si](C)(C)C(C)(C)C4359.7Semi standard non polar33892256
Eriojaposide A,3TBDMS,isomer #19CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O[Si](C)(C)C(C)(C)C)C2O[Si](C)(C)C(C)(C)C)C(O)C(O)C1O4258.0Semi standard non polar33892256
Eriojaposide A,3TBDMS,isomer #2CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C2O)C(O[Si](C)(C)C(C)(C)C)C(O)C1O4379.0Semi standard non polar33892256
Eriojaposide A,3TBDMS,isomer #20CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O[Si](C)(C)C(C)(C)C)C2O)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C1O4354.5Semi standard non polar33892256
Eriojaposide A,3TBDMS,isomer #21CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O[Si](C)(C)C(C)(C)C)C2O)C(O[Si](C)(C)C(C)(C)C)C(O)C1O[Si](C)(C)C(C)(C)C4346.2Semi standard non polar33892256
Eriojaposide A,3TBDMS,isomer #22CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O[Si](C)(C)C(C)(C)C)C2O)C(O[Si](C)(C)C(C)(C)C)C(O)C1O4235.4Semi standard non polar33892256
Eriojaposide A,3TBDMS,isomer #23CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O[Si](C)(C)C(C)(C)C)C2O)C(O)C(O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C(C)(C)C4349.3Semi standard non polar33892256
Eriojaposide A,3TBDMS,isomer #24CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O[Si](C)(C)C(C)(C)C)C2O)C(O)C(O[Si](C)(C)C(C)(C)C)C1O4206.9Semi standard non polar33892256
Eriojaposide A,3TBDMS,isomer #25CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O[Si](C)(C)C(C)(C)C)C2O)C(O)C(O)C1O[Si](C)(C)C(C)(C)C4235.3Semi standard non polar33892256
Eriojaposide A,3TBDMS,isomer #26CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O)C2O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C1O4368.8Semi standard non polar33892256
Eriojaposide A,3TBDMS,isomer #27CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O)C2O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C(O)C1O[Si](C)(C)C(C)(C)C4364.6Semi standard non polar33892256
Eriojaposide A,3TBDMS,isomer #28CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O)C2O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C(O)C1O4289.3Semi standard non polar33892256
Eriojaposide A,3TBDMS,isomer #29CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O)C2O[Si](C)(C)C(C)(C)C)C(O)C(O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C(C)(C)C4369.0Semi standard non polar33892256
Eriojaposide A,3TBDMS,isomer #3CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C2O)C(O)C(O[Si](C)(C)C(C)(C)C)C1O4358.0Semi standard non polar33892256
Eriojaposide A,3TBDMS,isomer #30CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O)C2O[Si](C)(C)C(C)(C)C)C(O)C(O[Si](C)(C)C(C)(C)C)C1O4247.0Semi standard non polar33892256
Eriojaposide A,3TBDMS,isomer #31CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O)C2O[Si](C)(C)C(C)(C)C)C(O)C(O)C1O[Si](C)(C)C(C)(C)C4287.1Semi standard non polar33892256
Eriojaposide A,3TBDMS,isomer #32CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O)C2O)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C(C)(C)C4420.2Semi standard non polar33892256
Eriojaposide A,3TBDMS,isomer #33CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O)C2O)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C1O4290.9Semi standard non polar33892256
Eriojaposide A,3TBDMS,isomer #34CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O)C2O)C(O[Si](C)(C)C(C)(C)C)C(O)C1O[Si](C)(C)C(C)(C)C4291.7Semi standard non polar33892256
Eriojaposide A,3TBDMS,isomer #35CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O)C(O)C2O)C(O)C(O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C(C)(C)C4293.9Semi standard non polar33892256
Eriojaposide A,3TBDMS,isomer #4CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C2O)C(O)C(O)C1O[Si](C)(C)C(C)(C)C4361.9Semi standard non polar33892256
Eriojaposide A,3TBDMS,isomer #5CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C2O)C(O)C(O)C1O4257.3Semi standard non polar33892256
Eriojaposide A,3TBDMS,isomer #6CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C(C)(C)C)C(O)C2O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C(O)C1O4405.8Semi standard non polar33892256
Eriojaposide A,3TBDMS,isomer #7CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C(C)(C)C)C(O)C2O[Si](C)(C)C(C)(C)C)C(O)C(O[Si](C)(C)C(C)(C)C)C1O4384.2Semi standard non polar33892256
Eriojaposide A,3TBDMS,isomer #8CC1=CC(=O)CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C(C)(C)C)C(O)C2O[Si](C)(C)C(C)(C)C)C(O)C(O)C1O[Si](C)(C)C(C)(C)C4389.1Semi standard non polar33892256
Eriojaposide A,3TBDMS,isomer #9CC1=CC(O[Si](C)(C)C(C)(C)C)=CC(C)(C)C1/C=C/C(C)OC1OC(COC2OCC(O[Si](C)(C)C(C)(C)C)C(O)C2O[Si](C)(C)C(C)(C)C)C(O)C(O)C1O4289.0Semi standard non polar33892256
Spectra

GC-MS Spectra

Spectrum TypeDescriptionSplash KeyDeposition DateSourceView
Predicted GC-MSPredicted GC-MS Spectrum - Eriojaposide A GC-MS (Non-derivatized) - 70eV, Positivesplash10-001c-2441900000-ce54c4726f41786fc1ec2017-09-01Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Eriojaposide A GC-MS (2 TMS) - 70eV, Positivesplash10-0040-3614229000-4cd25cbdbdeee41c01912017-10-06Wishart LabView Spectrum

MS/MS Spectra

Spectrum TypeDescriptionSplash KeyDeposition DateSourceView
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Eriojaposide A 10V, Positive-QTOFsplash10-0pbl-0982740000-85cf2ffe143dc33930be2016-08-02Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Eriojaposide A 20V, Positive-QTOFsplash10-0a4l-1951000000-ffb818ac5376db99c0fa2016-08-02Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Eriojaposide A 40V, Positive-QTOFsplash10-052f-2920000000-8606e41dbe9955af32a72016-08-02Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Eriojaposide A 10V, Negative-QTOFsplash10-0zgi-2892350000-02b6d67cd2ef671edcba2016-08-03Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Eriojaposide A 20V, Negative-QTOFsplash10-0a59-1981100000-ec6707157b1bd79955962016-08-03Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Eriojaposide A 40V, Negative-QTOFsplash10-0a4l-6960000000-f7c7a0c20faeb8c3b1ac2016-08-03Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Eriojaposide A 10V, Positive-QTOFsplash10-0006-0921310000-a5d62015cfcb62f804b52021-09-24Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Eriojaposide A 20V, Positive-QTOFsplash10-0udr-1900300000-b0cfa6250b7617c262802021-09-24Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Eriojaposide A 40V, Positive-QTOFsplash10-0fy5-2920000000-2a4a22c5211642f8adac2021-09-24Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Eriojaposide A 10V, Negative-QTOFsplash10-0a4i-0191230000-0857d17d80b240a779f02021-09-24Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Eriojaposide A 20V, Negative-QTOFsplash10-03y0-6926600000-4f14c8171588be2a2bb92021-09-24Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Eriojaposide A 40V, Negative-QTOFsplash10-0btl-7911100000-3635dedf3009e2a570fe2021-09-24Wishart LabView Spectrum

NMR Spectra

Spectrum TypeDescriptionDeposition DateSourceView
Predicted 1D NMR13C NMR Spectrum (1D, 100 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 100 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 1000 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 1000 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 200 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 200 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 300 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 300 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 400 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 400 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 500 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 500 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 600 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 600 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 700 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 700 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 800 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 800 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 900 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 900 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Biological Properties
Cellular Locations
  • Cytoplasm
  • Extracellular
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 IDFDB017238
KNApSAcK IDC00045920
Chemspider ID22913647
KEGG Compound IDNot Available
BioCyc IDNot Available
BiGG IDNot Available
Wikipedia LinkNot Available
METLIN IDNot Available
PubChem Compound13877687
PDB IDNot Available
ChEBI ID168653
Food Biomarker OntologyNot Available
VMH IDNot Available
MarkerDB IDNot Available
Good Scents IDrw1865371
References
Synthesis ReferenceNot Available
Material Safety Data Sheet (MSDS)Not Available
General References
  1. Simons K, Toomre D: Lipid rafts and signal transduction. Nat Rev Mol Cell Biol. 2000 Oct;1(1):31-9. [PubMed:11413487 ]
  2. Watson AD: Thematic review series: systems biology approaches to metabolic and cardiovascular disorders. Lipidomics: a global approach to lipid analysis in biological systems. J Lipid Res. 2006 Oct;47(10):2101-11. Epub 2006 Aug 10. [PubMed:16902246 ]
  3. Sethi JK, Vidal-Puig AJ: Thematic review series: adipocyte biology. Adipose tissue function and plasticity orchestrate nutritional adaptation. J Lipid Res. 2007 Jun;48(6):1253-62. Epub 2007 Mar 20. [PubMed:17374880 ]
  4. Lingwood D, Simons K: Lipid rafts as a membrane-organizing principle. Science. 2010 Jan 1;327(5961):46-50. doi: 10.1126/science.1174621. [PubMed:20044567 ]
  5. (). Yannai, Shmuel. (2004) Dictionary of food compounds with CD-ROM: Additives, flavors, and ingredients. Boca Raton: Chapman & Hall/CRC.. .
  6. Gunstone, Frank D., John L. Harwood, and Albert J. Dijkstra (2007). The lipid handbook with CD-ROM. CRC Press.