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Showing metabocard for Luteolin 4'-glucoside (HMDB0038468)

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enzymes (1) Show 1 protein
Record Information
Version5.0
StatusExpected but not Quantified
Creation Date2012-09-11 23:47:16 UTC
Update Date2022-03-07 02:55:47 UTC
HMDB IDHMDB0038468
Secondary Accession Numbers
  • HMDB38468
Metabolite Identification
Common NameLuteolin 4'-glucoside
DescriptionLuteolin 4'-glucoside belongs to the class of organic compounds known as flavonoid o-glycosides. Flavonoid O-glycosides are compounds containing a carbohydrate moiety which is O-glycosidically linked to the 2-phenylchromen-4-one flavonoid backbone. Luteolin 4'-glucoside has been detected, but not quantified in, pears (Pyrus communis). This could make luteolin 4'-glucoside a potential biomarker for the consumption of these foods. Based on a literature review very few articles have been published on Luteolin 4'-glucoside.
Structure
Thumb
MOL3D MOLSDF3D SDFPDB3D PDBSMILESInChI

MOL for HMDB0038468 (Luteolin 4'-glucoside)


  Mrv0541 05061310282D          

 32 35  0  0  0  0            999 V2000
    5.0013   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7158   -1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7158    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2868    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5737    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0013   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4302   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434    1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724    1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4302   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2868    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5737    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2881   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2881   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5737   -1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8592   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2881    1.2375    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145   -0.4125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.1447    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434    2.0625    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724    2.0625    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.0026    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.0026   -1.6500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.5737   -2.4750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724   -0.4125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.1447   -1.6500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.8592   -0.4125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  8  1  1  0  0  0  0
  8  3  2  0  0  0  0
  9  4  2  0  0  0  0
  9  5  1  0  0  0  0
 10  3  1  0  0  0  0
 11  4  1  0  0  0  0
 12  6  1  0  0  0  0
 13  2  1  0  0  0  0
 13 10  2  0  0  0  0
 14  6  2  0  0  0  0
 14  8  1  0  0  0  0
 15  5  2  0  0  0  0
 16  7  1  0  0  0  0
 17 11  2  0  0  0  0
 17 12  1  0  0  0  0
 17 15  1  0  0  0  0
 18 16  1  0  0  0  0
 19 18  1  0  0  0  0
 20 19  1  0  0  0  0
 21 20  1  0  0  0  0
 22  7  1  0  0  0  0
 23  9  1  0  0  0  0
 24 10  1  0  0  0  0
 25 11  1  0  0  0  0
 26 12  2  0  0  0  0
 27 18  1  0  0  0  0
 28 19  1  0  0  0  0
 29 20  1  0  0  0  0
 30 14  1  0  0  0  0
 30 15  1  0  0  0  0
 31 13  1  0  0  0  0
 31 21  1  0  0  0  0
 32 16  1  0  0  0  0
 32 21  1  0  0  0  0
M  END
Download

3D MOL for HMDB0038468 (Luteolin 4'-glucoside)

HMDB0038468
     RDKit          3D
Luteolin 4'-glucoside
 52 55  0  0  0  0  0  0  0  0999 V2000
    6.4010   -2.2963   -0.6868 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.6318   -1.3423   -0.4068 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2514   -1.5366   -0.4145 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4063   -0.5164   -0.1143 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9213   -0.6938   -0.1142 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3191   -1.8876   -0.4144 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0398   -1.9982   -0.4004 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8897   -0.9204   -0.0847 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1847   -1.1524   -0.1052 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2799   -0.3829    0.1359 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0420   -1.0146    1.1225 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2577   -0.4391    1.3404 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3543   -1.4832    1.2694 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3413   -2.0673    0.0090 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5460    0.7474    0.4874 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8117    1.2354    0.7243 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3447    0.4916   -0.9783 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2134    1.7395   -1.6029 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0644   -0.2849   -1.1710 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2294    0.3869   -2.0686 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2566    0.2561    0.2100 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0154    1.3846    0.5364 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1172    0.3682    0.1959 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8775    0.6590    0.1852 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.1590    0.9036    0.2096 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5873    2.1957    0.5417 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9208    2.4407    0.5645 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3936    3.7197    0.8917 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.8618    1.4909    0.2801 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4398    0.1938   -0.0535 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4134   -0.7230   -0.3301 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0862   -0.0880   -0.0856 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8888   -2.5287   -0.6684 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9299   -2.7347   -0.6608 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4712   -2.9790   -0.6491 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0366    0.6454    0.4031 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2651   -0.0780    2.4124 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3538   -1.0404    1.4334 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2052   -2.2879    2.0164 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.1966   -1.9664   -0.4616 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8219    1.5565    0.7828 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.0333    1.1275    1.6760 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2079   -0.0106   -1.4593 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4471    1.6804   -2.5597 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2550   -1.2873   -1.6083 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3174   -0.0343   -2.0202 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5303    2.2339    0.7481 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5553    1.3154    0.4353 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8867    2.9723    0.7720 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.6062    4.0125    1.8181 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.9244    1.6669    0.2932 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.4334   -1.6494   -0.5787 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0
  2  3  1  0
  3  4  2  0
  4  5  1  0
  5  6  2  0
  6  7  1  0
  7  8  2  0
  8  9  1  0
  9 10  1  0
 10 11  1  0
 11 12  1  0
 12 13  1  0
 13 14  1  0
 12 15  1  0
 15 16  1  0
 15 17  1  0
 17 18  1  0
 17 19  1  0
 19 20  1  0
  8 21  1  0
 21 22  1  0
 21 23  2  0
  4 24  1  0
 24 25  1  0
 25 26  2  0
 26 27  1  0
 27 28  1  0
 27 29  2  0
 29 30  1  0
 30 31  1  0
 30 32  2  0
 32  2  1  0
 23  5  1  0
 32 25  1  0
 19 10  1  0
  3 33  1  0
  6 34  1  0
  7 35  1  0
 10 36  1  0
 12 37  1  0
 13 38  1  0
 13 39  1  0
 14 40  1  0
 15 41  1  0
 16 42  1  0
 17 43  1  0
 18 44  1  0
 19 45  1  0
 20 46  1  0
 22 47  1  0
 23 48  1  0
 26 49  1  0
 28 50  1  0
 29 51  1  0
 31 52  1  0
M  END
Download

3D SDF for HMDB0038468 (Luteolin 4'-glucoside)


  Mrv0541 05061310282D          

 32 35  0  0  0  0            999 V2000
    5.0013   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7158   -1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7158    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2868    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5737    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0013   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4302   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434    1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724    1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4302   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2868    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5737    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2881   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2881   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5737   -1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8592   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2881    1.2375    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145   -0.4125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.1447    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434    2.0625    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724    2.0625    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.0026    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.0026   -1.6500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.5737   -2.4750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724   -0.4125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.1447   -1.6500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.8592   -0.4125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  8  1  1  0  0  0  0
  8  3  2  0  0  0  0
  9  4  2  0  0  0  0
  9  5  1  0  0  0  0
 10  3  1  0  0  0  0
 11  4  1  0  0  0  0
 12  6  1  0  0  0  0
 13  2  1  0  0  0  0
 13 10  2  0  0  0  0
 14  6  2  0  0  0  0
 14  8  1  0  0  0  0
 15  5  2  0  0  0  0
 16  7  1  0  0  0  0
 17 11  2  0  0  0  0
 17 12  1  0  0  0  0
 17 15  1  0  0  0  0
 18 16  1  0  0  0  0
 19 18  1  0  0  0  0
 20 19  1  0  0  0  0
 21 20  1  0  0  0  0
 22  7  1  0  0  0  0
 23  9  1  0  0  0  0
 24 10  1  0  0  0  0
 25 11  1  0  0  0  0
 26 12  2  0  0  0  0
 27 18  1  0  0  0  0
 28 19  1  0  0  0  0
 29 20  1  0  0  0  0
 30 14  1  0  0  0  0
 30 15  1  0  0  0  0
 31 13  1  0  0  0  0
 31 21  1  0  0  0  0
 32 16  1  0  0  0  0
 32 21  1  0  0  0  0
M  END
> <DATABASE_ID>
HMDB0038468

> <DATABASE_NAME>
hmdb

> <SMILES>
OCC1OC(OC2=C(O)C=C(C=C2)C2=CC(=O)C3=C(O)C=C(O)C=C3O2)C(O)C(O)C1O

> <INCHI_IDENTIFIER>
InChI=1S/C21H20O11/c22-7-16-18(27)19(28)20(29)21(32-16)31-13-2-1-8(3-10(13)24)14-6-12(26)17-11(25)4-9(23)5-15(17)30-14/h1-6,16,18-25,27-29H,7H2

> <INCHI_KEY>
UHNXUSWGOJMEFO-UHFFFAOYSA-N

> <FORMULA>
C21H20O11

> <MOLECULAR_WEIGHT>
448.3769

> <EXACT_MASS>
448.100561482

> <JCHEM_ACCEPTOR_COUNT>
11

> <JCHEM_AVERAGE_POLARIZABILITY>
43.18571421901525

> <JCHEM_BIOAVAILABILITY>
0

> <JCHEM_DONOR_COUNT>
7

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
1

> <JCHEM_IUPAC>
5,7-dihydroxy-2-(3-hydroxy-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)-4H-chromen-4-one

> <ALOGPS_LOGP>
0.56

> <JCHEM_LOGP>
0.1350557186666665

> <ALOGPS_LOGS>
-2.64

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
4

> <JCHEM_PHYSIOLOGICAL_CHARGE>
-1

> <JCHEM_PKA>
9.055655794335241

> <JCHEM_PKA_STRONGEST_ACIDIC>
6.637075621406041

> <JCHEM_PKA_STRONGEST_BASIC>
-2.9810923549038426

> <JCHEM_POLAR_SURFACE_AREA>
186.36999999999998

> <JCHEM_REFRACTIVITY>
107.03919999999998

> <JCHEM_ROTATABLE_BOND_COUNT>
4

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
1.02e+00 g/l

> <JCHEM_TRADITIONAL_IUPAC>
5,7-dihydroxy-2-(3-hydroxy-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)chromen-4-one

> <JCHEM_VEBER_RULE>
0

$$$$
Download

3D-SDF for HMDB0038468 (Luteolin 4'-glucoside)

HMDB0038468
     RDKit          3D
Luteolin 4'-glucoside
 52 55  0  0  0  0  0  0  0  0999 V2000
    6.4010   -2.2963   -0.6868 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.6318   -1.3423   -0.4068 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2514   -1.5366   -0.4145 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4063   -0.5164   -0.1143 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9213   -0.6938   -0.1142 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3191   -1.8876   -0.4144 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0398   -1.9982   -0.4004 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8897   -0.9204   -0.0847 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1847   -1.1524   -0.1052 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2799   -0.3829    0.1359 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0420   -1.0146    1.1225 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2577   -0.4391    1.3404 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3543   -1.4832    1.2694 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3413   -2.0673    0.0090 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5460    0.7474    0.4874 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8117    1.2354    0.7243 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3447    0.4916   -0.9783 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2134    1.7395   -1.6029 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0644   -0.2849   -1.1710 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2294    0.3869   -2.0686 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2566    0.2561    0.2100 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0154    1.3846    0.5364 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1172    0.3682    0.1959 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8775    0.6590    0.1852 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.1590    0.9036    0.2096 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5873    2.1957    0.5417 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9208    2.4407    0.5645 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3936    3.7197    0.8917 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.8618    1.4909    0.2801 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4398    0.1938   -0.0535 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4134   -0.7230   -0.3301 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0862   -0.0880   -0.0856 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8888   -2.5287   -0.6684 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9299   -2.7347   -0.6608 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4712   -2.9790   -0.6491 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0366    0.6454    0.4031 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2651   -0.0780    2.4124 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3538   -1.0404    1.4334 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2052   -2.2879    2.0164 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.1966   -1.9664   -0.4616 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8219    1.5565    0.7828 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.0333    1.1275    1.6760 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2079   -0.0106   -1.4593 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4471    1.6804   -2.5597 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2550   -1.2873   -1.6083 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3174   -0.0343   -2.0202 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5303    2.2339    0.7481 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5553    1.3154    0.4353 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8867    2.9723    0.7720 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.6062    4.0125    1.8181 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.9244    1.6669    0.2932 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.4334   -1.6494   -0.5787 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0
  2  3  1  0
  3  4  2  0
  4  5  1  0
  5  6  2  0
  6  7  1  0
  7  8  2  0
  8  9  1  0
  9 10  1  0
 10 11  1  0
 11 12  1  0
 12 13  1  0
 13 14  1  0
 12 15  1  0
 15 16  1  0
 15 17  1  0
 17 18  1  0
 17 19  1  0
 19 20  1  0
  8 21  1  0
 21 22  1  0
 21 23  2  0
  4 24  1  0
 24 25  1  0
 25 26  2  0
 26 27  1  0
 27 28  1  0
 27 29  2  0
 29 30  1  0
 30 31  1  0
 30 32  2  0
 32  2  1  0
 23  5  1  0
 32 25  1  0
 19 10  1  0
  3 33  1  0
  6 34  1  0
  7 35  1  0
 10 36  1  0
 12 37  1  0
 13 38  1  0
 13 39  1  0
 14 40  1  0
 15 41  1  0
 16 42  1  0
 17 43  1  0
 18 44  1  0
 19 45  1  0
 20 46  1  0
 22 47  1  0
 23 48  1  0
 26 49  1  0
 28 50  1  0
 29 51  1  0
 31 52  1  0
M  END
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PDB for HMDB0038468 (Luteolin 4'-glucoside)

HEADER    PROTEIN                                 06-MAY-13   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   06-MAY-13         0                                  
HETATM    1  C   UNK     0       9.336  -2.310   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0      10.669  -3.080   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0      10.669   0.000   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0       2.667   1.540   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0       4.001  -0.770   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0       8.002   1.540   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0      16.004   1.540   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0       9.336  -0.770   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0       2.667   0.000   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0      12.003  -0.770   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0       4.001   2.310   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0       6.668   2.310   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0      12.003  -2.310   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0       8.002   0.000   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0       5.335   0.000   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0      16.004   0.000   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0       5.335   1.540   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0      17.338  -0.770   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0      17.338  -2.310   0.000  0.00  0.00           C+0
HETATM   20  C   UNK     0      16.004  -3.080   0.000  0.00  0.00           C+0
HETATM   21  C   UNK     0      14.671  -2.310   0.000  0.00  0.00           C+0
HETATM   22  O   UNK     0      17.338   2.310   0.000  0.00  0.00           O+0
HETATM   23  O   UNK     0       1.334  -0.770   0.000  0.00  0.00           O+0
HETATM   24  O   UNK     0      13.337   0.000   0.000  0.00  0.00           O+0
HETATM   25  O   UNK     0       4.001   3.850   0.000  0.00  0.00           O+0
HETATM   26  O   UNK     0       6.668   3.850   0.000  0.00  0.00           O+0
HETATM   27  O   UNK     0      18.672   0.000   0.000  0.00  0.00           O+0
HETATM   28  O   UNK     0      18.672  -3.080   0.000  0.00  0.00           O+0
HETATM   29  O   UNK     0      16.004  -4.620   0.000  0.00  0.00           O+0
HETATM   30  O   UNK     0       6.668  -0.770   0.000  0.00  0.00           O+0
HETATM   31  O   UNK     0      13.337  -3.080   0.000  0.00  0.00           O+0
HETATM   32  O   UNK     0      14.671  -0.770   0.000  0.00  0.00           O+0
CONECT    1    2    8                                                       
CONECT    2    1   13                                                       
CONECT    3    8   10                                                       
CONECT    4    9   11                                                       
CONECT    5    9   15                                                       
CONECT    6   12   14                                                       
CONECT    7   16   22                                                       
CONECT    8    1    3   14                                                  
CONECT    9    4    5   23                                                  
CONECT   10    3   13   24                                                  
CONECT   11    4   17   25                                                  
CONECT   12    6   17   26                                                  
CONECT   13    2   10   31                                                  
CONECT   14    6    8   30                                                  
CONECT   15    5   17   30                                                  
CONECT   16    7   18   32                                                  
CONECT   17   11   12   15                                                  
CONECT   18   16   19   27                                                  
CONECT   19   18   20   28                                                  
CONECT   20   19   21   29                                                  
CONECT   21   20   31   32                                                  
CONECT   22    7                                                            
CONECT   23    9                                                            
CONECT   24   10                                                            
CONECT   25   11                                                            
CONECT   26   12                                                            
CONECT   27   18                                                            
CONECT   28   19                                                            
CONECT   29   20                                                            
CONECT   30   14   15                                                       
CONECT   31   13   21                                                       
CONECT   32   16   21                                                       
MASTER        0    0    0    0    0    0    0    0   32    0   70    0
END
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3D PDB for HMDB0038468 (Luteolin 4'-glucoside)

COMPND    HMDB0254224
HETATM    1  O1  UNL     1       5.611  -1.806   2.488  1.00  0.00           O  
HETATM    2  C1  UNL     1       5.162  -1.043   1.618  1.00  0.00           C  
HETATM    3  C2  UNL     1       3.794  -0.932   1.372  1.00  0.00           C  
HETATM    4  C3  UNL     1       3.314  -0.089   0.413  1.00  0.00           C  
HETATM    5  C4  UNL     1       1.897   0.043   0.139  1.00  0.00           C  
HETATM    6  C5  UNL     1       1.452   0.924  -0.857  1.00  0.00           C  
HETATM    7  C6  UNL     1       0.128   1.069  -1.137  1.00  0.00           C  
HETATM    8  C7  UNL     1      -0.873   0.366  -0.466  1.00  0.00           C  
HETATM    9  O2  UNL     1      -2.175   0.537  -0.772  1.00  0.00           O  
HETATM   10  C8  UNL     1      -3.381   0.058  -0.363  1.00  0.00           C  
HETATM   11  O3  UNL     1      -4.253   1.016   0.137  1.00  0.00           O  
HETATM   12  C9  UNL     1      -5.519   0.599   0.378  1.00  0.00           C  
HETATM   13  C10 UNL     1      -6.569   1.440  -0.363  1.00  0.00           C  
HETATM   14  O4  UNL     1      -6.489   2.768   0.029  1.00  0.00           O  
HETATM   15  C11 UNL     1      -5.780  -0.854   0.172  1.00  0.00           C  
HETATM   16  O5  UNL     1      -5.272  -1.655   1.196  1.00  0.00           O  
HETATM   17  C12 UNL     1      -5.275  -1.395  -1.131  1.00  0.00           C  
HETATM   18  O6  UNL     1      -5.131  -2.770  -1.099  1.00  0.00           O  
HETATM   19  C13 UNL     1      -4.004  -0.710  -1.522  1.00  0.00           C  
HETATM   20  O7  UNL     1      -4.189   0.123  -2.629  1.00  0.00           O  
HETATM   21  C14 UNL     1      -0.434  -0.493   0.507  1.00  0.00           C  
HETATM   22  O8  UNL     1      -1.330  -1.248   1.243  1.00  0.00           O  
HETATM   23  C15 UNL     1       0.932  -0.659   0.812  1.00  0.00           C  
HETATM   24  O9  UNL     1       4.163   0.616  -0.274  1.00  0.00           O  
HETATM   25  C16 UNL     1       5.452   0.548  -0.082  1.00  0.00           C  
HETATM   26  C17 UNL     1       6.252   1.351  -0.880  1.00  0.00           C  
HETATM   27  C18 UNL     1       7.614   1.331  -0.733  1.00  0.00           C  
HETATM   28  O10 UNL     1       8.372   2.158  -1.561  1.00  0.00           O  
HETATM   29  C19 UNL     1       8.186   0.527   0.192  1.00  0.00           C  
HETATM   30  C20 UNL     1       7.391  -0.293   1.009  1.00  0.00           C  
HETATM   31  O11 UNL     1       8.031  -1.065   1.906  1.00  0.00           O  
HETATM   32  C21 UNL     1       6.025  -0.283   0.873  1.00  0.00           C  
HETATM   33  H1  UNL     1       3.157  -1.545   1.979  1.00  0.00           H  
HETATM   34  H2  UNL     1       2.237   1.475  -1.383  1.00  0.00           H  
HETATM   35  H3  UNL     1      -0.186   1.748  -1.903  1.00  0.00           H  
HETATM   36  H4  UNL     1      -3.281  -0.682   0.448  1.00  0.00           H  
HETATM   37  H5  UNL     1      -5.729   0.809   1.470  1.00  0.00           H  
HETATM   38  H6  UNL     1      -7.589   1.083  -0.129  1.00  0.00           H  
HETATM   39  H7  UNL     1      -6.414   1.296  -1.439  1.00  0.00           H  
HETATM   40  H8  UNL     1      -5.759   2.852   0.675  1.00  0.00           H  
HETATM   41  H9  UNL     1      -6.898  -1.012   0.202  1.00  0.00           H  
HETATM   42  H10 UNL     1      -5.349  -1.128   2.029  1.00  0.00           H  
HETATM   43  H11 UNL     1      -6.043  -1.157  -1.910  1.00  0.00           H  
HETATM   44  H12 UNL     1      -6.063  -3.148  -1.145  1.00  0.00           H  
HETATM   45  H13 UNL     1      -3.286  -1.493  -1.844  1.00  0.00           H  
HETATM   46  H14 UNL     1      -3.459   0.031  -3.290  1.00  0.00           H  
HETATM   47  H15 UNL     1      -1.012  -1.868   1.945  1.00  0.00           H  
HETATM   48  H16 UNL     1       1.212  -1.350   1.587  1.00  0.00           H  
HETATM   49  H17 UNL     1       5.809   2.006  -1.631  1.00  0.00           H  
HETATM   50  H18 UNL     1       8.562   3.084  -1.223  1.00  0.00           H  
HETATM   51  H19 UNL     1       9.271   0.514   0.306  1.00  0.00           H  
HETATM   52  H20 UNL     1       7.715  -1.692   2.557  1.00  0.00           H  
CONECT    1    2    2
CONECT    2    3   32
CONECT    3    4    4   33
CONECT    4    5   24
CONECT    5    6    6   23
CONECT    6    7   34
CONECT    7    8    8   35
CONECT    8    9   21
CONECT    9   10
CONECT   10   11   19   36
CONECT   11   12
CONECT   12   13   15   37
CONECT   13   14   38   39
CONECT   14   40
CONECT   15   16   17   41
CONECT   16   42
CONECT   17   18   19   43
CONECT   18   44
CONECT   19   20   45
CONECT   20   46
CONECT   21   22   23   23
CONECT   22   47
CONECT   23   48
CONECT   24   25
CONECT   25   26   26   32
CONECT   26   27   49
CONECT   27   28   29   29
CONECT   28   50
CONECT   29   30   51
CONECT   30   31   32   32
CONECT   31   52
END
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SMILES for HMDB0038468 (Luteolin 4'-glucoside)

OCC1OC(OC2=C(O)C=C(C=C2)C2=CC(=O)C3=C(O)C=C(O)C=C3O2)C(O)C(O)C1O
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INCHI for HMDB0038468 (Luteolin 4'-glucoside)

InChI=1S/C21H20O11/c22-7-16-18(27)19(28)20(29)21(32-16)31-13-2-1-8(3-10(13)24)14-6-12(26)17-11(25)4-9(23)5-15(17)30-14/h1-6,16,18-25,27-29H,7H2
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View in JSmolView Stereo Labels
Synonyms
ValueSource
(-)-Luteolin 4'-O-beta-glucosideHMDB
Juncein?HMDB
Luteolin 4'-O-beta-glucosideHMDB
Luteolin 4'-O-glucosideHMDB, MeSH
Chemical FormulaC21H20O11
Average Molecular Weight448.3769
Monoisotopic Molecular Weight448.100561482
IUPAC Name5,7-dihydroxy-2-(3-hydroxy-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)-4H-chromen-4-one
Traditional Name5,7-dihydroxy-2-(3-hydroxy-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)chromen-4-one
CAS Registry Number6920-38-3
SMILES
OCC1OC(OC2=C(O)C=C(C=C2)C2=CC(=O)C3=C(O)C=C(O)C=C3O2)C(O)C(O)C1O
InChI Identifier
InChI=1S/C21H20O11/c22-7-16-18(27)19(28)20(29)21(32-16)31-13-2-1-8(3-10(13)24)14-6-12(26)17-11(25)4-9(23)5-15(17)30-14/h1-6,16,18-25,27-29H,7H2
InChI KeyUHNXUSWGOJMEFO-UHFFFAOYSA-N
Chemical Taxonomy
Description Belongs to the class of organic compounds known as flavonoid o-glycosides. Flavonoid O-glycosides are compounds containing a carbohydrate moiety which is O-glycosidically linked to the 2-phenylchromen-4-one flavonoid backbone.
KingdomOrganic compounds
Super ClassPhenylpropanoids and polyketides
ClassFlavonoids
Sub ClassFlavonoid glycosides
Direct ParentFlavonoid O-glycosides
Alternative Parents
Substituents
  • Flavonoid-4p-o-glycoside
  • Flavonoid o-glycoside
  • 3'-hydroxyflavonoid
  • 5-hydroxyflavonoid
  • 7-hydroxyflavonoid
  • Flavone
  • Hydroxyflavonoid
  • Phenolic glycoside
  • Hexose monosaccharide
  • Chromone
  • Glycosyl compound
  • O-glycosyl compound
  • Benzopyran
  • 1-benzopyran
  • Phenoxy compound
  • Phenol ether
  • Pyranone
  • Phenol
  • 1-hydroxy-4-unsubstituted benzenoid
  • 1-hydroxy-2-unsubstituted benzenoid
  • Pyran
  • Oxane
  • Monosaccharide
  • Benzenoid
  • Monocyclic benzene moiety
  • Vinylogous acid
  • Heteroaromatic compound
  • Secondary alcohol
  • Polyol
  • Acetal
  • Organoheterocyclic compound
  • Oxacycle
  • Organooxygen compound
  • Alcohol
  • Organic oxygen compound
  • Organic oxide
  • Hydrocarbon derivative
  • Primary alcohol
  • Aromatic heteropolycyclic compound
Molecular FrameworkAromatic heteropolycyclic compounds
External DescriptorsNot Available
Ontology
Physiological effectNot Available
Disposition
Biological locationSource
ProcessNot Available
RoleNot Available
Physical Properties
StateSolid
Experimental Molecular Properties
PropertyValueReference
Melting Point178 - 179 °CNot Available
Boiling PointNot AvailableNot Available
Water SolubilityNot AvailableNot Available
LogPNot AvailableNot Available
Experimental Chromatographic PropertiesNot Available
Predicted Molecular Properties
PropertyValueSource
Water Solubility1.02 g/LALOGPS
logP0.56ALOGPS
logP0.14ChemAxon
logS-2.6ALOGPS
pKa (Strongest Acidic)6.64ChemAxon
pKa (Strongest Basic)-3ChemAxon
Physiological Charge-1ChemAxon
Hydrogen Acceptor Count11ChemAxon
Hydrogen Donor Count7ChemAxon
Polar Surface Area186.37 ŲChemAxon
Rotatable Bond Count4ChemAxon
Refractivity107.04 m³·mol⁻¹ChemAxon
Polarizability43.19 ųChemAxon
Number of Rings4ChemAxon
BioavailabilityNoChemAxon
Rule of FiveNoChemAxon
Ghose FilterYesChemAxon
Veber's RuleNoChemAxon
MDDR-like RuleNoChemAxon
Predicted Chromatographic Properties

Predicted Collision Cross Sections

PredictorAdduct TypeCCS Value (Å2)Reference
DeepCCS[M+H]+202.27830932474
DeepCCS[M-H]-199.88330932474
DeepCCS[M-2H]-232.83130932474
DeepCCS[M+Na]+208.19130932474
AllCCS[M+H]+202.832859911
AllCCS[M+H-H2O]+200.432859911
AllCCS[M+NH4]+205.032859911
AllCCS[M+Na]+205.632859911
AllCCS[M-H]-199.332859911
AllCCS[M+Na-2H]-199.732859911
AllCCS[M+HCOO]-200.332859911

Predicted Kovats Retention Indices

Underivatized

MetaboliteSMILESKovats RI ValueColumn TypeReference
Luteolin 4'-glucosideOCC1OC(OC2=C(O)C=C(C=C2)C2=CC(=O)C3=C(O)C=C(O)C=C3O2)C(O)C(O)C1O5751.1Standard polar33892256
Luteolin 4'-glucosideOCC1OC(OC2=C(O)C=C(C=C2)C2=CC(=O)C3=C(O)C=C(O)C=C3O2)C(O)C(O)C1O4346.1Standard non polar33892256
Luteolin 4'-glucosideOCC1OC(OC2=C(O)C=C(C=C2)C2=CC(=O)C3=C(O)C=C(O)C=C3O2)C(O)C(O)C1O4529.1Semi standard non polar33892256

Derivatized

Derivative Name / StructureSMILESKovats RI ValueColumn TypeReference
Luteolin 4'-glucoside,1TMS,isomer #1C[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O)C=C(O)C=C4O3)C=C2O)C(O)C(O)C1O4519.2Semi standard non polar33892256
Luteolin 4'-glucoside,1TMS,isomer #2C[Si](C)(C)OC1=CC(C2=CC(=O)C3=C(O)C=C(O)C=C3O2)=CC=C1OC1OC(CO)C(O)C(O)C1O4484.3Semi standard non polar33892256
Luteolin 4'-glucoside,1TMS,isomer #3C[Si](C)(C)OC1=CC(O)=CC2=C1C(=O)C=C(C1=CC=C(OC3OC(CO)C(O)C(O)C3O)C(O)=C1)O24499.3Semi standard non polar33892256
Luteolin 4'-glucoside,1TMS,isomer #4C[Si](C)(C)OC1=CC(O)=C2C(=O)C=C(C3=CC=C(OC4OC(CO)C(O)C(O)C4O)C(O)=C3)OC2=C14594.5Semi standard non polar33892256
Luteolin 4'-glucoside,1TMS,isomer #5C[Si](C)(C)OC1C(OC2=CC=C(C3=CC(=O)C4=C(O)C=C(O)C=C4O3)C=C2O)OC(CO)C(O)C1O4545.0Semi standard non polar33892256
Luteolin 4'-glucoside,1TMS,isomer #6C[Si](C)(C)OC1C(O)C(CO)OC(OC2=CC=C(C3=CC(=O)C4=C(O)C=C(O)C=C4O3)C=C2O)C1O4551.6Semi standard non polar33892256
Luteolin 4'-glucoside,1TMS,isomer #7C[Si](C)(C)OC1C(CO)OC(OC2=CC=C(C3=CC(=O)C4=C(O)C=C(O)C=C4O3)C=C2O)C(O)C1O4544.1Semi standard non polar33892256
Luteolin 4'-glucoside,2TMS,isomer #1C[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O[Si](C)(C)C)C=C(O)C=C4O3)C=C2O)C(O)C(O)C1O4408.6Semi standard non polar33892256
Luteolin 4'-glucoside,2TMS,isomer #10C[Si](C)(C)OC1=CC(C2=CC(=O)C3=C(O)C=C(O)C=C3O2)=CC=C1OC1OC(CO)C(O)C(O[Si](C)(C)C)C1O4388.4Semi standard non polar33892256
Luteolin 4'-glucoside,2TMS,isomer #11C[Si](C)(C)OC1=CC(C2=CC(=O)C3=C(O)C=C(O)C=C3O2)=CC=C1OC1OC(CO)C(O)C(O)C1O[Si](C)(C)C4403.6Semi standard non polar33892256
Luteolin 4'-glucoside,2TMS,isomer #12C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C=C(C3=CC=C(OC4OC(CO)C(O)C(O)C4O)C(O)=C3)OC2=C14429.6Semi standard non polar33892256
Luteolin 4'-glucoside,2TMS,isomer #13C[Si](C)(C)OC1=CC(O)=CC2=C1C(=O)C=C(C1=CC=C(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3O)C(O)=C1)O24399.4Semi standard non polar33892256
Luteolin 4'-glucoside,2TMS,isomer #14C[Si](C)(C)OC1=CC(O)=CC2=C1C(=O)C=C(C1=CC=C(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3O)C(O)=C1)O24379.0Semi standard non polar33892256
Luteolin 4'-glucoside,2TMS,isomer #15C[Si](C)(C)OC1=CC(O)=CC2=C1C(=O)C=C(C1=CC=C(OC3OC(CO)C(O)C(O)C3O[Si](C)(C)C)C(O)=C1)O24411.7Semi standard non polar33892256
Luteolin 4'-glucoside,2TMS,isomer #16C[Si](C)(C)OC1=CC(O)=C2C(=O)C=C(C3=CC=C(OC4OC(CO)C(O[Si](C)(C)C)C(O)C4O)C(O)=C3)OC2=C14442.9Semi standard non polar33892256
Luteolin 4'-glucoside,2TMS,isomer #17C[Si](C)(C)OC1=CC(O)=C2C(=O)C=C(C3=CC=C(OC4OC(CO)C(O)C(O[Si](C)(C)C)C4O)C(O)=C3)OC2=C14430.9Semi standard non polar33892256
Luteolin 4'-glucoside,2TMS,isomer #18C[Si](C)(C)OC1=CC(O)=C2C(=O)C=C(C3=CC=C(OC4OC(CO)C(O)C(O)C4O[Si](C)(C)C)C(O)=C3)OC2=C14451.1Semi standard non polar33892256
Luteolin 4'-glucoside,2TMS,isomer #19C[Si](C)(C)OC1C(CO)OC(OC2=CC=C(C3=CC(=O)C4=C(O)C=C(O)C=C4O3)C=C2O)C(O[Si](C)(C)C)C1O4432.8Semi standard non polar33892256
Luteolin 4'-glucoside,2TMS,isomer #2C[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O)C=C(O[Si](C)(C)C)C=C4O3)C=C2O)C(O)C(O)C1O4454.6Semi standard non polar33892256
Luteolin 4'-glucoside,2TMS,isomer #20C[Si](C)(C)OC1C(OC2=CC=C(C3=CC(=O)C4=C(O)C=C(O)C=C4O3)C=C2O)OC(CO)C(O)C1O[Si](C)(C)C4437.6Semi standard non polar33892256
Luteolin 4'-glucoside,2TMS,isomer #21C[Si](C)(C)OC1C(CO)OC(OC2=CC=C(C3=CC(=O)C4=C(O)C=C(O)C=C4O3)C=C2O)C(O)C1O[Si](C)(C)C4415.4Semi standard non polar33892256
Luteolin 4'-glucoside,2TMS,isomer #3C[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O)C=C(O)C=C4O3)C=C2O[Si](C)(C)C)C(O)C(O)C1O4385.2Semi standard non polar33892256
Luteolin 4'-glucoside,2TMS,isomer #4C[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O)C=C(O)C=C4O3)C=C2O)C(O[Si](C)(C)C)C(O)C1O4432.5Semi standard non polar33892256
Luteolin 4'-glucoside,2TMS,isomer #5C[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O)C=C(O)C=C4O3)C=C2O)C(O)C(O[Si](C)(C)C)C1O4430.4Semi standard non polar33892256
Luteolin 4'-glucoside,2TMS,isomer #6C[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O)C=C(O)C=C4O3)C=C2O)C(O)C(O)C1O[Si](C)(C)C4419.3Semi standard non polar33892256
Luteolin 4'-glucoside,2TMS,isomer #7C[Si](C)(C)OC1=CC(C2=CC(=O)C3=C(O[Si](C)(C)C)C=C(O)C=C3O2)=CC=C1OC1OC(CO)C(O)C(O)C1O4391.6Semi standard non polar33892256
Luteolin 4'-glucoside,2TMS,isomer #8C[Si](C)(C)OC1=CC(O)=C2C(=O)C=C(C3=CC=C(OC4OC(CO)C(O)C(O)C4O)C(O[Si](C)(C)C)=C3)OC2=C14436.2Semi standard non polar33892256
Luteolin 4'-glucoside,2TMS,isomer #9C[Si](C)(C)OC1=CC(C2=CC(=O)C3=C(O)C=C(O)C=C3O2)=CC=C1OC1OC(CO)C(O[Si](C)(C)C)C(O)C1O4394.0Semi standard non polar33892256
Luteolin 4'-glucoside,3TMS,isomer #1C[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C4O3)C=C2O)C(O)C(O)C1O4255.3Semi standard non polar33892256
Luteolin 4'-glucoside,3TMS,isomer #10C[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O)C=C(O)C=C4O3)C=C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O4272.7Semi standard non polar33892256
Luteolin 4'-glucoside,3TMS,isomer #11C[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O)C=C(O)C=C4O3)C=C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O4247.5Semi standard non polar33892256
Luteolin 4'-glucoside,3TMS,isomer #12C[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O)C=C(O)C=C4O3)C=C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C4257.4Semi standard non polar33892256
Luteolin 4'-glucoside,3TMS,isomer #13C[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O)C=C(O)C=C4O3)C=C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O4314.8Semi standard non polar33892256
Luteolin 4'-glucoside,3TMS,isomer #14C[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O)C=C(O)C=C4O3)C=C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C4328.9Semi standard non polar33892256
Luteolin 4'-glucoside,3TMS,isomer #15C[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O)C=C(O)C=C4O3)C=C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C4297.0Semi standard non polar33892256
Luteolin 4'-glucoside,3TMS,isomer #16C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C=C(C3=CC=C(OC4OC(CO)C(O)C(O)C4O)C(O[Si](C)(C)C)=C3)OC2=C14256.1Semi standard non polar33892256
Luteolin 4'-glucoside,3TMS,isomer #17C[Si](C)(C)OC1=CC(C2=CC(=O)C3=C(O[Si](C)(C)C)C=C(O)C=C3O2)=CC=C1OC1OC(CO)C(O[Si](C)(C)C)C(O)C1O4229.7Semi standard non polar33892256
Luteolin 4'-glucoside,3TMS,isomer #18C[Si](C)(C)OC1=CC(C2=CC(=O)C3=C(O[Si](C)(C)C)C=C(O)C=C3O2)=CC=C1OC1OC(CO)C(O)C(O[Si](C)(C)C)C1O4189.7Semi standard non polar33892256
Luteolin 4'-glucoside,3TMS,isomer #19C[Si](C)(C)OC1=CC(C2=CC(=O)C3=C(O[Si](C)(C)C)C=C(O)C=C3O2)=CC=C1OC1OC(CO)C(O)C(O)C1O[Si](C)(C)C4237.8Semi standard non polar33892256
Luteolin 4'-glucoside,3TMS,isomer #2C[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O[Si](C)(C)C)C=C(O)C=C4O3)C=C2O[Si](C)(C)C)C(O)C(O)C1O4218.6Semi standard non polar33892256
Luteolin 4'-glucoside,3TMS,isomer #20C[Si](C)(C)OC1=CC(O)=C2C(=O)C=C(C3=CC=C(OC4OC(CO)C(O[Si](C)(C)C)C(O)C4O)C(O[Si](C)(C)C)=C3)OC2=C14275.2Semi standard non polar33892256
Luteolin 4'-glucoside,3TMS,isomer #21C[Si](C)(C)OC1=CC(O)=C2C(=O)C=C(C3=CC=C(OC4OC(CO)C(O)C(O[Si](C)(C)C)C4O)C(O[Si](C)(C)C)=C3)OC2=C14247.0Semi standard non polar33892256
Luteolin 4'-glucoside,3TMS,isomer #22C[Si](C)(C)OC1=CC(O)=C2C(=O)C=C(C3=CC=C(OC4OC(CO)C(O)C(O)C4O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC2=C14282.7Semi standard non polar33892256
Luteolin 4'-glucoside,3TMS,isomer #23C[Si](C)(C)OC1=CC(C2=CC(=O)C3=C(O)C=C(O)C=C3O2)=CC=C1OC1OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O4249.7Semi standard non polar33892256
Luteolin 4'-glucoside,3TMS,isomer #24C[Si](C)(C)OC1=CC(C2=CC(=O)C3=C(O)C=C(O)C=C3O2)=CC=C1OC1OC(CO)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C4273.9Semi standard non polar33892256
Luteolin 4'-glucoside,3TMS,isomer #25C[Si](C)(C)OC1=CC(C2=CC(=O)C3=C(O)C=C(O)C=C3O2)=CC=C1OC1OC(CO)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C4278.4Semi standard non polar33892256
Luteolin 4'-glucoside,3TMS,isomer #26C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C=C(C3=CC=C(OC4OC(CO)C(O[Si](C)(C)C)C(O)C4O)C(O)=C3)OC2=C14253.1Semi standard non polar33892256
Luteolin 4'-glucoside,3TMS,isomer #27C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C=C(C3=CC=C(OC4OC(CO)C(O)C(O[Si](C)(C)C)C4O)C(O)=C3)OC2=C14254.3Semi standard non polar33892256
Luteolin 4'-glucoside,3TMS,isomer #28C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C=C(C3=CC=C(OC4OC(CO)C(O)C(O)C4O[Si](C)(C)C)C(O)=C3)OC2=C14244.5Semi standard non polar33892256
Luteolin 4'-glucoside,3TMS,isomer #29C[Si](C)(C)OC1=CC(O)=CC2=C1C(=O)C=C(C1=CC=C(OC3OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C3O)C(O)=C1)O24218.5Semi standard non polar33892256
Luteolin 4'-glucoside,3TMS,isomer #3C[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O[Si](C)(C)C)C=C(O)C=C4O3)C=C2O)C(O[Si](C)(C)C)C(O)C1O4267.8Semi standard non polar33892256
Luteolin 4'-glucoside,3TMS,isomer #30C[Si](C)(C)OC1=CC(O)=CC2=C1C(=O)C=C(C1=CC=C(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3O[Si](C)(C)C)C(O)=C1)O24250.2Semi standard non polar33892256
Luteolin 4'-glucoside,3TMS,isomer #31C[Si](C)(C)OC1=CC(O)=CC2=C1C(=O)C=C(C1=CC=C(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3O[Si](C)(C)C)C(O)=C1)O24245.1Semi standard non polar33892256
Luteolin 4'-glucoside,3TMS,isomer #32C[Si](C)(C)OC1=CC(O)=C2C(=O)C=C(C3=CC=C(OC4OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C4O)C(O)=C3)OC2=C14261.7Semi standard non polar33892256
Luteolin 4'-glucoside,3TMS,isomer #33C[Si](C)(C)OC1=CC(O)=C2C(=O)C=C(C3=CC=C(OC4OC(CO)C(O[Si](C)(C)C)C(O)C4O[Si](C)(C)C)C(O)=C3)OC2=C14289.9Semi standard non polar33892256
Luteolin 4'-glucoside,3TMS,isomer #34C[Si](C)(C)OC1=CC(O)=C2C(=O)C=C(C3=CC=C(OC4OC(CO)C(O)C(O[Si](C)(C)C)C4O[Si](C)(C)C)C(O)=C3)OC2=C14293.8Semi standard non polar33892256
Luteolin 4'-glucoside,3TMS,isomer #35C[Si](C)(C)OC1C(CO)OC(OC2=CC=C(C3=CC(=O)C4=C(O)C=C(O)C=C4O3)C=C2O)C(O[Si](C)(C)C)C1O[Si](C)(C)C4320.4Semi standard non polar33892256
Luteolin 4'-glucoside,3TMS,isomer #4C[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O[Si](C)(C)C)C=C(O)C=C4O3)C=C2O)C(O)C(O[Si](C)(C)C)C1O4224.7Semi standard non polar33892256
Luteolin 4'-glucoside,3TMS,isomer #5C[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O[Si](C)(C)C)C=C(O)C=C4O3)C=C2O)C(O)C(O)C1O[Si](C)(C)C4255.7Semi standard non polar33892256
Luteolin 4'-glucoside,3TMS,isomer #6C[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O)C=C(O[Si](C)(C)C)C=C4O3)C=C2O[Si](C)(C)C)C(O)C(O)C1O4259.8Semi standard non polar33892256
Luteolin 4'-glucoside,3TMS,isomer #7C[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O)C=C(O[Si](C)(C)C)C=C4O3)C=C2O)C(O[Si](C)(C)C)C(O)C1O4304.6Semi standard non polar33892256
Luteolin 4'-glucoside,3TMS,isomer #8C[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O)C=C(O[Si](C)(C)C)C=C4O3)C=C2O)C(O)C(O[Si](C)(C)C)C1O4275.4Semi standard non polar33892256
Luteolin 4'-glucoside,3TMS,isomer #9C[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O)C=C(O[Si](C)(C)C)C=C4O3)C=C2O)C(O)C(O)C1O[Si](C)(C)C4293.6Semi standard non polar33892256
Luteolin 4'-glucoside,4TMS,isomer #1C[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C4O3)C=C2O[Si](C)(C)C)C(O)C(O)C1O4108.4Semi standard non polar33892256
Luteolin 4'-glucoside,4TMS,isomer #10C[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O[Si](C)(C)C)C=C(O)C=C4O3)C=C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C4130.2Semi standard non polar33892256
Luteolin 4'-glucoside,4TMS,isomer #11C[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O)C=C(O[Si](C)(C)C)C=C4O3)C=C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O4169.9Semi standard non polar33892256
Luteolin 4'-glucoside,4TMS,isomer #12C[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O)C=C(O[Si](C)(C)C)C=C4O3)C=C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O4126.3Semi standard non polar33892256
Luteolin 4'-glucoside,4TMS,isomer #13C[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O)C=C(O[Si](C)(C)C)C=C4O3)C=C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C4159.0Semi standard non polar33892256
Luteolin 4'-glucoside,4TMS,isomer #14C[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O)C=C(O[Si](C)(C)C)C=C4O3)C=C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O4178.5Semi standard non polar33892256
Luteolin 4'-glucoside,4TMS,isomer #15C[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O)C=C(O[Si](C)(C)C)C=C4O3)C=C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C4214.7Semi standard non polar33892256
Luteolin 4'-glucoside,4TMS,isomer #16C[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O)C=C(O[Si](C)(C)C)C=C4O3)C=C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C4173.4Semi standard non polar33892256
Luteolin 4'-glucoside,4TMS,isomer #17C[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O)C=C(O)C=C4O3)C=C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O4178.7Semi standard non polar33892256
Luteolin 4'-glucoside,4TMS,isomer #18C[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O)C=C(O)C=C4O3)C=C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C4204.4Semi standard non polar33892256
Luteolin 4'-glucoside,4TMS,isomer #19C[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O)C=C(O)C=C4O3)C=C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C4172.6Semi standard non polar33892256
Luteolin 4'-glucoside,4TMS,isomer #2C[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C4O3)C=C2O)C(O[Si](C)(C)C)C(O)C1O4145.1Semi standard non polar33892256
Luteolin 4'-glucoside,4TMS,isomer #20C[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O)C=C(O)C=C4O3)C=C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C4250.5Semi standard non polar33892256
Luteolin 4'-glucoside,4TMS,isomer #21C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C=C(C3=CC=C(OC4OC(CO)C(O[Si](C)(C)C)C(O)C4O)C(O[Si](C)(C)C)=C3)OC2=C14137.9Semi standard non polar33892256
Luteolin 4'-glucoside,4TMS,isomer #22C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C=C(C3=CC=C(OC4OC(CO)C(O)C(O[Si](C)(C)C)C4O)C(O[Si](C)(C)C)=C3)OC2=C14130.8Semi standard non polar33892256
Luteolin 4'-glucoside,4TMS,isomer #23C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C=C(C3=CC=C(OC4OC(CO)C(O)C(O)C4O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC2=C14128.3Semi standard non polar33892256
Luteolin 4'-glucoside,4TMS,isomer #24C[Si](C)(C)OC1=CC(C2=CC(=O)C3=C(O[Si](C)(C)C)C=C(O)C=C3O2)=CC=C1OC1OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O4090.6Semi standard non polar33892256
Luteolin 4'-glucoside,4TMS,isomer #25C[Si](C)(C)OC1=CC(C2=CC(=O)C3=C(O[Si](C)(C)C)C=C(O)C=C3O2)=CC=C1OC1OC(CO)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C4115.4Semi standard non polar33892256
Luteolin 4'-glucoside,4TMS,isomer #26C[Si](C)(C)OC1=CC(C2=CC(=O)C3=C(O[Si](C)(C)C)C=C(O)C=C3O2)=CC=C1OC1OC(CO)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C4104.2Semi standard non polar33892256
Luteolin 4'-glucoside,4TMS,isomer #27C[Si](C)(C)OC1=CC(O)=C2C(=O)C=C(C3=CC=C(OC4OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C4O)C(O[Si](C)(C)C)=C3)OC2=C14144.3Semi standard non polar33892256
Luteolin 4'-glucoside,4TMS,isomer #28C[Si](C)(C)OC1=CC(O)=C2C(=O)C=C(C3=CC=C(OC4OC(CO)C(O[Si](C)(C)C)C(O)C4O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC2=C14167.0Semi standard non polar33892256
Luteolin 4'-glucoside,4TMS,isomer #29C[Si](C)(C)OC1=CC(O)=C2C(=O)C=C(C3=CC=C(OC4OC(CO)C(O)C(O[Si](C)(C)C)C4O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC2=C14159.5Semi standard non polar33892256
Luteolin 4'-glucoside,4TMS,isomer #3C[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C4O3)C=C2O)C(O)C(O[Si](C)(C)C)C1O4160.2Semi standard non polar33892256
Luteolin 4'-glucoside,4TMS,isomer #30C[Si](C)(C)OC1=CC(C2=CC(=O)C3=C(O)C=C(O)C=C3O2)=CC=C1OC1OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C4180.9Semi standard non polar33892256
Luteolin 4'-glucoside,4TMS,isomer #31C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C=C(C3=CC=C(OC4OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C4O)C(O)=C3)OC2=C14139.1Semi standard non polar33892256
Luteolin 4'-glucoside,4TMS,isomer #32C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C=C(C3=CC=C(OC4OC(CO)C(O[Si](C)(C)C)C(O)C4O[Si](C)(C)C)C(O)=C3)OC2=C14146.1Semi standard non polar33892256
Luteolin 4'-glucoside,4TMS,isomer #33C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C=C(C3=CC=C(OC4OC(CO)C(O)C(O[Si](C)(C)C)C4O[Si](C)(C)C)C(O)=C3)OC2=C14149.6Semi standard non polar33892256
Luteolin 4'-glucoside,4TMS,isomer #34C[Si](C)(C)OC1=CC(O)=CC2=C1C(=O)C=C(C1=CC=C(OC3OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C3O[Si](C)(C)C)C(O)=C1)O24137.5Semi standard non polar33892256
Luteolin 4'-glucoside,4TMS,isomer #35C[Si](C)(C)OC1=CC(O)=C2C(=O)C=C(C3=CC=C(OC4OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C4O[Si](C)(C)C)C(O)=C3)OC2=C14179.1Semi standard non polar33892256
Luteolin 4'-glucoside,4TMS,isomer #4C[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C4O3)C=C2O)C(O)C(O)C1O[Si](C)(C)C4147.7Semi standard non polar33892256
Luteolin 4'-glucoside,4TMS,isomer #5C[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O[Si](C)(C)C)C=C(O)C=C4O3)C=C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O4124.0Semi standard non polar33892256
Luteolin 4'-glucoside,4TMS,isomer #6C[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O[Si](C)(C)C)C=C(O)C=C4O3)C=C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O4065.7Semi standard non polar33892256
Luteolin 4'-glucoside,4TMS,isomer #7C[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O[Si](C)(C)C)C=C(O)C=C4O3)C=C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C4108.9Semi standard non polar33892256
Luteolin 4'-glucoside,4TMS,isomer #8C[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O[Si](C)(C)C)C=C(O)C=C4O3)C=C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O4137.5Semi standard non polar33892256
Luteolin 4'-glucoside,4TMS,isomer #9C[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O[Si](C)(C)C)C=C(O)C=C4O3)C=C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C4178.6Semi standard non polar33892256
Luteolin 4'-glucoside,5TMS,isomer #1C[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C4O3)C=C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O4077.1Semi standard non polar33892256
Luteolin 4'-glucoside,5TMS,isomer #10C[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O[Si](C)(C)C)C=C(O)C=C4O3)C=C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C4127.9Semi standard non polar33892256
Luteolin 4'-glucoside,5TMS,isomer #11C[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O)C=C(O[Si](C)(C)C)C=C4O3)C=C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O4111.7Semi standard non polar33892256
Luteolin 4'-glucoside,5TMS,isomer #12C[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O)C=C(O[Si](C)(C)C)C=C4O3)C=C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C4130.9Semi standard non polar33892256
Luteolin 4'-glucoside,5TMS,isomer #13C[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O)C=C(O[Si](C)(C)C)C=C4O3)C=C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C4106.3Semi standard non polar33892256
Luteolin 4'-glucoside,5TMS,isomer #14C[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O)C=C(O[Si](C)(C)C)C=C4O3)C=C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C4168.6Semi standard non polar33892256
Luteolin 4'-glucoside,5TMS,isomer #15C[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O)C=C(O)C=C4O3)C=C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C4172.5Semi standard non polar33892256
Luteolin 4'-glucoside,5TMS,isomer #16C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C=C(C3=CC=C(OC4OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C4O)C(O[Si](C)(C)C)=C3)OC2=C14059.3Semi standard non polar33892256
Luteolin 4'-glucoside,5TMS,isomer #17C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C=C(C3=CC=C(OC4OC(CO)C(O[Si](C)(C)C)C(O)C4O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC2=C14089.1Semi standard non polar33892256
Luteolin 4'-glucoside,5TMS,isomer #18C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C=C(C3=CC=C(OC4OC(CO)C(O)C(O[Si](C)(C)C)C4O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC2=C14071.7Semi standard non polar33892256
Luteolin 4'-glucoside,5TMS,isomer #19C[Si](C)(C)OC1=CC(C2=CC(=O)C3=C(O[Si](C)(C)C)C=C(O)C=C3O2)=CC=C1OC1OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C4056.5Semi standard non polar33892256
Luteolin 4'-glucoside,5TMS,isomer #2C[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C4O3)C=C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O4075.0Semi standard non polar33892256
Luteolin 4'-glucoside,5TMS,isomer #20C[Si](C)(C)OC1=CC(O)=C2C(=O)C=C(C3=CC=C(OC4OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C4O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC2=C14109.7Semi standard non polar33892256
Luteolin 4'-glucoside,5TMS,isomer #21C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C=C(C3=CC=C(OC4OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C4O[Si](C)(C)C)C(O)=C3)OC2=C14086.7Semi standard non polar33892256
Luteolin 4'-glucoside,5TMS,isomer #3C[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C4O3)C=C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C4068.1Semi standard non polar33892256
Luteolin 4'-glucoside,5TMS,isomer #4C[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C4O3)C=C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O4103.2Semi standard non polar33892256
Luteolin 4'-glucoside,5TMS,isomer #5C[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C4O3)C=C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C4125.9Semi standard non polar33892256
Luteolin 4'-glucoside,5TMS,isomer #6C[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C4O3)C=C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C4099.1Semi standard non polar33892256
Luteolin 4'-glucoside,5TMS,isomer #7C[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O[Si](C)(C)C)C=C(O)C=C4O3)C=C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O4060.2Semi standard non polar33892256
Luteolin 4'-glucoside,5TMS,isomer #8C[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O[Si](C)(C)C)C=C(O)C=C4O3)C=C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C4080.5Semi standard non polar33892256
Luteolin 4'-glucoside,5TMS,isomer #9C[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O[Si](C)(C)C)C=C(O)C=C4O3)C=C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C4056.4Semi standard non polar33892256
Luteolin 4'-glucoside,6TMS,isomer #1C[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C4O3)C=C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O4049.1Semi standard non polar33892256
Luteolin 4'-glucoside,6TMS,isomer #2C[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C4O3)C=C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C4054.9Semi standard non polar33892256
Luteolin 4'-glucoside,6TMS,isomer #3C[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C4O3)C=C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C4045.6Semi standard non polar33892256
Luteolin 4'-glucoside,6TMS,isomer #4C[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C4O3)C=C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C4074.8Semi standard non polar33892256
Luteolin 4'-glucoside,6TMS,isomer #5C[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O[Si](C)(C)C)C=C(O)C=C4O3)C=C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C4065.8Semi standard non polar33892256
Luteolin 4'-glucoside,6TMS,isomer #6C[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O)C=C(O[Si](C)(C)C)C=C4O3)C=C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C4105.3Semi standard non polar33892256
Luteolin 4'-glucoside,6TMS,isomer #7C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C=C(C3=CC=C(OC4OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C4O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC2=C14034.7Semi standard non polar33892256
Luteolin 4'-glucoside,1TBDMS,isomer #1CC(C)(C)[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O)C=C(O)C=C4O3)C=C2O)C(O)C(O)C1O4791.1Semi standard non polar33892256
Luteolin 4'-glucoside,1TBDMS,isomer #2CC(C)(C)[Si](C)(C)OC1=CC(C2=CC(=O)C3=C(O)C=C(O)C=C3O2)=CC=C1OC1OC(CO)C(O)C(O)C1O4745.4Semi standard non polar33892256
Luteolin 4'-glucoside,1TBDMS,isomer #3CC(C)(C)[Si](C)(C)OC1=CC(O)=CC2=C1C(=O)C=C(C1=CC=C(OC3OC(CO)C(O)C(O)C3O)C(O)=C1)O24751.1Semi standard non polar33892256
Luteolin 4'-glucoside,1TBDMS,isomer #4CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=O)C=C(C3=CC=C(OC4OC(CO)C(O)C(O)C4O)C(O)=C3)OC2=C14815.5Semi standard non polar33892256
Luteolin 4'-glucoside,1TBDMS,isomer #5CC(C)(C)[Si](C)(C)OC1C(OC2=CC=C(C3=CC(=O)C4=C(O)C=C(O)C=C4O3)C=C2O)OC(CO)C(O)C1O4832.3Semi standard non polar33892256
Luteolin 4'-glucoside,1TBDMS,isomer #6CC(C)(C)[Si](C)(C)OC1C(O)C(CO)OC(OC2=CC=C(C3=CC(=O)C4=C(O)C=C(O)C=C4O3)C=C2O)C1O4831.0Semi standard non polar33892256
Luteolin 4'-glucoside,1TBDMS,isomer #7CC(C)(C)[Si](C)(C)OC1C(CO)OC(OC2=CC=C(C3=CC(=O)C4=C(O)C=C(O)C=C4O3)C=C2O)C(O)C1O4830.9Semi standard non polar33892256
Luteolin 4'-glucoside,2TBDMS,isomer #1CC(C)(C)[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O[Si](C)(C)C(C)(C)C)C=C(O)C=C4O3)C=C2O)C(O)C(O)C1O4860.9Semi standard non polar33892256
Luteolin 4'-glucoside,2TBDMS,isomer #10CC(C)(C)[Si](C)(C)OC1=CC(C2=CC(=O)C3=C(O)C=C(O)C=C3O2)=CC=C1OC1OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C1O4850.4Semi standard non polar33892256
Luteolin 4'-glucoside,2TBDMS,isomer #11CC(C)(C)[Si](C)(C)OC1=CC(C2=CC(=O)C3=C(O)C=C(O)C=C3O2)=CC=C1OC1OC(CO)C(O)C(O)C1O[Si](C)(C)C(C)(C)C4856.3Semi standard non polar33892256
Luteolin 4'-glucoside,2TBDMS,isomer #12CC(C)(C)[Si](C)(C)OC1=CC(O[Si](C)(C)C(C)(C)C)=C2C(=O)C=C(C3=CC=C(OC4OC(CO)C(O)C(O)C4O)C(O)=C3)OC2=C14881.0Semi standard non polar33892256
Luteolin 4'-glucoside,2TBDMS,isomer #13CC(C)(C)[Si](C)(C)OC1=CC(O)=CC2=C1C(=O)C=C(C1=CC=C(OC3OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C3O)C(O)=C1)O24856.3Semi standard non polar33892256
Luteolin 4'-glucoside,2TBDMS,isomer #14CC(C)(C)[Si](C)(C)OC1=CC(O)=CC2=C1C(=O)C=C(C1=CC=C(OC3OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C3O)C(O)=C1)O24860.1Semi standard non polar33892256
Luteolin 4'-glucoside,2TBDMS,isomer #15CC(C)(C)[Si](C)(C)OC1=CC(O)=CC2=C1C(=O)C=C(C1=CC=C(OC3OC(CO)C(O)C(O)C3O[Si](C)(C)C(C)(C)C)C(O)=C1)O24857.3Semi standard non polar33892256
Luteolin 4'-glucoside,2TBDMS,isomer #16CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=O)C=C(C3=CC=C(OC4OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C4O)C(O)=C3)OC2=C14925.1Semi standard non polar33892256
Luteolin 4'-glucoside,2TBDMS,isomer #17CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=O)C=C(C3=CC=C(OC4OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C4O)C(O)=C3)OC2=C14930.2Semi standard non polar33892256
Luteolin 4'-glucoside,2TBDMS,isomer #18CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=O)C=C(C3=CC=C(OC4OC(CO)C(O)C(O)C4O[Si](C)(C)C(C)(C)C)C(O)=C3)OC2=C14927.4Semi standard non polar33892256
Luteolin 4'-glucoside,2TBDMS,isomer #19CC(C)(C)[Si](C)(C)OC1C(CO)OC(OC2=CC=C(C3=CC(=O)C4=C(O)C=C(O)C=C4O3)C=C2O)C(O[Si](C)(C)C(C)(C)C)C1O4937.2Semi standard non polar33892256
Luteolin 4'-glucoside,2TBDMS,isomer #2CC(C)(C)[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O)C=C(O[Si](C)(C)C(C)(C)C)C=C4O3)C=C2O)C(O)C(O)C1O4921.4Semi standard non polar33892256
Luteolin 4'-glucoside,2TBDMS,isomer #20CC(C)(C)[Si](C)(C)OC1C(OC2=CC=C(C3=CC(=O)C4=C(O)C=C(O)C=C4O3)C=C2O)OC(CO)C(O)C1O[Si](C)(C)C(C)(C)C4949.3Semi standard non polar33892256
Luteolin 4'-glucoside,2TBDMS,isomer #21CC(C)(C)[Si](C)(C)OC1C(CO)OC(OC2=CC=C(C3=CC(=O)C4=C(O)C=C(O)C=C4O3)C=C2O)C(O)C1O[Si](C)(C)C(C)(C)C4909.6Semi standard non polar33892256
Luteolin 4'-glucoside,2TBDMS,isomer #3CC(C)(C)[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O)C=C(O)C=C4O3)C=C2O[Si](C)(C)C(C)(C)C)C(O)C(O)C1O4855.6Semi standard non polar33892256
Luteolin 4'-glucoside,2TBDMS,isomer #4CC(C)(C)[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O)C=C(O)C=C4O3)C=C2O)C(O[Si](C)(C)C(C)(C)C)C(O)C1O4934.3Semi standard non polar33892256
Luteolin 4'-glucoside,2TBDMS,isomer #5CC(C)(C)[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O)C=C(O)C=C4O3)C=C2O)C(O)C(O[Si](C)(C)C(C)(C)C)C1O4938.2Semi standard non polar33892256
Luteolin 4'-glucoside,2TBDMS,isomer #6CC(C)(C)[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O)C=C(O)C=C4O3)C=C2O)C(O)C(O)C1O[Si](C)(C)C(C)(C)C4922.0Semi standard non polar33892256
Luteolin 4'-glucoside,2TBDMS,isomer #7CC(C)(C)[Si](C)(C)OC1=CC(C2=CC(=O)C3=C(O[Si](C)(C)C(C)(C)C)C=C(O)C=C3O2)=CC=C1OC1OC(CO)C(O)C(O)C1O4816.8Semi standard non polar33892256
Luteolin 4'-glucoside,2TBDMS,isomer #8CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=O)C=C(C3=CC=C(OC4OC(CO)C(O)C(O)C4O)C(O[Si](C)(C)C(C)(C)C)=C3)OC2=C14887.2Semi standard non polar33892256
Luteolin 4'-glucoside,2TBDMS,isomer #9CC(C)(C)[Si](C)(C)OC1=CC(C2=CC(=O)C3=C(O)C=C(O)C=C3O2)=CC=C1OC1OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C1O4852.4Semi standard non polar33892256
Luteolin 4'-glucoside,3TBDMS,isomer #1CC(C)(C)[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O[Si](C)(C)C(C)(C)C)C=C(O[Si](C)(C)C(C)(C)C)C=C4O3)C=C2O)C(O)C(O)C1O4963.1Semi standard non polar33892256
Luteolin 4'-glucoside,3TBDMS,isomer #10CC(C)(C)[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O)C=C(O)C=C4O3)C=C2O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C(O)C1O4900.2Semi standard non polar33892256
Luteolin 4'-glucoside,3TBDMS,isomer #11CC(C)(C)[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O)C=C(O)C=C4O3)C=C2O[Si](C)(C)C(C)(C)C)C(O)C(O[Si](C)(C)C(C)(C)C)C1O4903.7Semi standard non polar33892256
Luteolin 4'-glucoside,3TBDMS,isomer #12CC(C)(C)[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O)C=C(O)C=C4O3)C=C2O[Si](C)(C)C(C)(C)C)C(O)C(O)C1O[Si](C)(C)C(C)(C)C4891.5Semi standard non polar33892256
Luteolin 4'-glucoside,3TBDMS,isomer #13CC(C)(C)[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O)C=C(O)C=C4O3)C=C2O)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C1O4952.6Semi standard non polar33892256
Luteolin 4'-glucoside,3TBDMS,isomer #14CC(C)(C)[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O)C=C(O)C=C4O3)C=C2O)C(O[Si](C)(C)C(C)(C)C)C(O)C1O[Si](C)(C)C(C)(C)C4974.2Semi standard non polar33892256
Luteolin 4'-glucoside,3TBDMS,isomer #15CC(C)(C)[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O)C=C(O)C=C4O3)C=C2O)C(O)C(O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C(C)(C)C4949.1Semi standard non polar33892256
Luteolin 4'-glucoside,3TBDMS,isomer #16CC(C)(C)[Si](C)(C)OC1=CC(O[Si](C)(C)C(C)(C)C)=C2C(=O)C=C(C3=CC=C(OC4OC(CO)C(O)C(O)C4O)C(O[Si](C)(C)C(C)(C)C)=C3)OC2=C14952.8Semi standard non polar33892256
Luteolin 4'-glucoside,3TBDMS,isomer #17CC(C)(C)[Si](C)(C)OC1=CC(C2=CC(=O)C3=C(O[Si](C)(C)C(C)(C)C)C=C(O)C=C3O2)=CC=C1OC1OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C1O4869.5Semi standard non polar33892256
Luteolin 4'-glucoside,3TBDMS,isomer #18CC(C)(C)[Si](C)(C)OC1=CC(C2=CC(=O)C3=C(O[Si](C)(C)C(C)(C)C)C=C(O)C=C3O2)=CC=C1OC1OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C1O4858.4Semi standard non polar33892256
Luteolin 4'-glucoside,3TBDMS,isomer #19CC(C)(C)[Si](C)(C)OC1=CC(C2=CC(=O)C3=C(O[Si](C)(C)C(C)(C)C)C=C(O)C=C3O2)=CC=C1OC1OC(CO)C(O)C(O)C1O[Si](C)(C)C(C)(C)C4864.5Semi standard non polar33892256
Luteolin 4'-glucoside,3TBDMS,isomer #2CC(C)(C)[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O[Si](C)(C)C(C)(C)C)C=C(O)C=C4O3)C=C2O[Si](C)(C)C(C)(C)C)C(O)C(O)C1O4868.6Semi standard non polar33892256
Luteolin 4'-glucoside,3TBDMS,isomer #20CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=O)C=C(C3=CC=C(OC4OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C4O)C(O[Si](C)(C)C(C)(C)C)=C3)OC2=C14940.0Semi standard non polar33892256
Luteolin 4'-glucoside,3TBDMS,isomer #21CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=O)C=C(C3=CC=C(OC4OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C4O)C(O[Si](C)(C)C(C)(C)C)=C3)OC2=C14937.1Semi standard non polar33892256
Luteolin 4'-glucoside,3TBDMS,isomer #22CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=O)C=C(C3=CC=C(OC4OC(CO)C(O)C(O)C4O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)=C3)OC2=C14935.5Semi standard non polar33892256
Luteolin 4'-glucoside,3TBDMS,isomer #23CC(C)(C)[Si](C)(C)OC1=CC(C2=CC(=O)C3=C(O)C=C(O)C=C3O2)=CC=C1OC1OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C1O4879.3Semi standard non polar33892256
Luteolin 4'-glucoside,3TBDMS,isomer #24CC(C)(C)[Si](C)(C)OC1=CC(C2=CC(=O)C3=C(O)C=C(O)C=C3O2)=CC=C1OC1OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C1O[Si](C)(C)C(C)(C)C4902.2Semi standard non polar33892256
Luteolin 4'-glucoside,3TBDMS,isomer #25CC(C)(C)[Si](C)(C)OC1=CC(C2=CC(=O)C3=C(O)C=C(O)C=C3O2)=CC=C1OC1OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C(C)(C)C4903.8Semi standard non polar33892256
Luteolin 4'-glucoside,3TBDMS,isomer #26CC(C)(C)[Si](C)(C)OC1=CC(O[Si](C)(C)C(C)(C)C)=C2C(=O)C=C(C3=CC=C(OC4OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C4O)C(O)=C3)OC2=C14977.8Semi standard non polar33892256
Luteolin 4'-glucoside,3TBDMS,isomer #27CC(C)(C)[Si](C)(C)OC1=CC(O[Si](C)(C)C(C)(C)C)=C2C(=O)C=C(C3=CC=C(OC4OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C4O)C(O)=C3)OC2=C14996.5Semi standard non polar33892256
Luteolin 4'-glucoside,3TBDMS,isomer #28CC(C)(C)[Si](C)(C)OC1=CC(O[Si](C)(C)C(C)(C)C)=C2C(=O)C=C(C3=CC=C(OC4OC(CO)C(O)C(O)C4O[Si](C)(C)C(C)(C)C)C(O)=C3)OC2=C14950.8Semi standard non polar33892256
Luteolin 4'-glucoside,3TBDMS,isomer #29CC(C)(C)[Si](C)(C)OC1=CC(O)=CC2=C1C(=O)C=C(C1=CC=C(OC3OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C3O)C(O)=C1)O24900.9Semi standard non polar33892256
Luteolin 4'-glucoside,3TBDMS,isomer #3CC(C)(C)[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O[Si](C)(C)C(C)(C)C)C=C(O)C=C4O3)C=C2O)C(O[Si](C)(C)C(C)(C)C)C(O)C1O4894.0Semi standard non polar33892256
Luteolin 4'-glucoside,3TBDMS,isomer #30CC(C)(C)[Si](C)(C)OC1=CC(O)=CC2=C1C(=O)C=C(C1=CC=C(OC3OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C3O[Si](C)(C)C(C)(C)C)C(O)=C1)O24914.7Semi standard non polar33892256
Luteolin 4'-glucoside,3TBDMS,isomer #31CC(C)(C)[Si](C)(C)OC1=CC(O)=CC2=C1C(=O)C=C(C1=CC=C(OC3OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C3O[Si](C)(C)C(C)(C)C)C(O)=C1)O24916.4Semi standard non polar33892256
Luteolin 4'-glucoside,3TBDMS,isomer #32CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=O)C=C(C3=CC=C(OC4OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C4O)C(O)=C3)OC2=C14958.7Semi standard non polar33892256
Luteolin 4'-glucoside,3TBDMS,isomer #33CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=O)C=C(C3=CC=C(OC4OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C4O[Si](C)(C)C(C)(C)C)C(O)=C3)OC2=C14976.6Semi standard non polar33892256
Luteolin 4'-glucoside,3TBDMS,isomer #34CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=O)C=C(C3=CC=C(OC4OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C4O[Si](C)(C)C(C)(C)C)C(O)=C3)OC2=C14982.1Semi standard non polar33892256
Luteolin 4'-glucoside,3TBDMS,isomer #35CC(C)(C)[Si](C)(C)OC1C(CO)OC(OC2=CC=C(C3=CC(=O)C4=C(O)C=C(O)C=C4O3)C=C2O)C(O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C(C)(C)C4957.1Semi standard non polar33892256
Luteolin 4'-glucoside,3TBDMS,isomer #4CC(C)(C)[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O[Si](C)(C)C(C)(C)C)C=C(O)C=C4O3)C=C2O)C(O)C(O[Si](C)(C)C(C)(C)C)C1O4908.8Semi standard non polar33892256
Luteolin 4'-glucoside,3TBDMS,isomer #5CC(C)(C)[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O[Si](C)(C)C(C)(C)C)C=C(O)C=C4O3)C=C2O)C(O)C(O)C1O[Si](C)(C)C(C)(C)C4892.6Semi standard non polar33892256
Luteolin 4'-glucoside,3TBDMS,isomer #6CC(C)(C)[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O)C=C(O[Si](C)(C)C(C)(C)C)C=C4O3)C=C2O[Si](C)(C)C(C)(C)C)C(O)C(O)C1O4940.3Semi standard non polar33892256
Luteolin 4'-glucoside,3TBDMS,isomer #7CC(C)(C)[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O)C=C(O[Si](C)(C)C(C)(C)C)C=C4O3)C=C2O)C(O[Si](C)(C)C(C)(C)C)C(O)C1O4956.9Semi standard non polar33892256
Luteolin 4'-glucoside,3TBDMS,isomer #8CC(C)(C)[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O)C=C(O[Si](C)(C)C(C)(C)C)C=C4O3)C=C2O)C(O)C(O[Si](C)(C)C(C)(C)C)C1O4981.0Semi standard non polar33892256
Luteolin 4'-glucoside,3TBDMS,isomer #9CC(C)(C)[Si](C)(C)OCC1OC(OC2=CC=C(C3=CC(=O)C4=C(O)C=C(O[Si](C)(C)C(C)(C)C)C=C4O3)C=C2O)C(O)C(O)C1O[Si](C)(C)C(C)(C)C4956.3Semi standard non polar33892256
Spectra

GC-MS Spectra

Spectrum TypeDescriptionSplash KeyDeposition DateSourceView
Predicted GC-MSPredicted GC-MS Spectrum - Luteolin 4'-glucoside GC-MS (Non-derivatized) - 70eV, Positivesplash10-001i-8934600000-c8e4d33f9553175fe3bb2017-09-01Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Luteolin 4'-glucoside GC-MS (3 TMS) - 70eV, Positivesplash10-0f92-3363159000-f67408f361bb0512cb152017-10-06Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Luteolin 4'-glucoside GC-MS (Non-derivatized) - 70eV, PositiveNot Available2021-10-12Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Luteolin 4'-glucoside GC-MS (Non-derivatized) - 70eV, PositiveNot Available2021-10-12Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Luteolin 4'-glucoside GC-MS (TMS_1_1) - 70eV, PositiveNot Available2021-11-04Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Luteolin 4'-glucoside GC-MS (TMS_1_2) - 70eV, PositiveNot Available2021-11-04Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Luteolin 4'-glucoside GC-MS (TMS_1_3) - 70eV, PositiveNot Available2021-11-04Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Luteolin 4'-glucoside GC-MS (TMS_1_4) - 70eV, PositiveNot Available2021-11-04Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Luteolin 4'-glucoside GC-MS (TMS_1_5) - 70eV, PositiveNot Available2021-11-04Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Luteolin 4'-glucoside GC-MS (TMS_1_6) - 70eV, PositiveNot Available2021-11-04Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Luteolin 4'-glucoside GC-MS (TMS_1_7) - 70eV, PositiveNot Available2021-11-04Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Luteolin 4'-glucoside GC-MS (TMS_2_1) - 70eV, PositiveNot Available2021-11-04Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Luteolin 4'-glucoside GC-MS (TMS_2_2) - 70eV, PositiveNot Available2021-11-04Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Luteolin 4'-glucoside GC-MS (TMS_2_3) - 70eV, PositiveNot Available2021-11-04Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Luteolin 4'-glucoside GC-MS (TMS_2_4) - 70eV, PositiveNot Available2021-11-04Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Luteolin 4'-glucoside GC-MS (TMS_2_5) - 70eV, PositiveNot Available2021-11-04Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Luteolin 4'-glucoside GC-MS (TMS_2_6) - 70eV, PositiveNot Available2021-11-04Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Luteolin 4'-glucoside GC-MS (TMS_2_7) - 70eV, PositiveNot Available2021-11-04Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Luteolin 4'-glucoside GC-MS (TMS_2_8) - 70eV, PositiveNot Available2021-11-04Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Luteolin 4'-glucoside GC-MS (TMS_2_9) - 70eV, PositiveNot Available2021-11-04Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Luteolin 4'-glucoside GC-MS (TMS_2_10) - 70eV, PositiveNot Available2021-11-04Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Luteolin 4'-glucoside GC-MS (TMS_2_11) - 70eV, PositiveNot Available2021-11-04Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Luteolin 4'-glucoside GC-MS (TMS_2_12) - 70eV, PositiveNot Available2021-11-04Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Luteolin 4'-glucoside GC-MS (TMS_2_13) - 70eV, PositiveNot Available2021-11-04Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Luteolin 4'-glucoside GC-MS (TMS_2_14) - 70eV, PositiveNot Available2021-11-04Wishart LabView Spectrum

MS/MS Spectra

Spectrum TypeDescriptionSplash KeyDeposition DateSourceView
Experimental LC-MS/MSLC-MS/MS Spectrum - Luteolin 4'-glucoside 6V, Positive-QTOFsplash10-001i-0920000000-3d3baf578d319bd2776a2021-09-20HMDB team, MONAView Spectrum
Experimental LC-MS/MSLC-MS/MS Spectrum - Luteolin 4'-glucoside 6V, Negative-QTOFsplash10-000i-0090100000-6f49d81216936d8b55a92021-09-20HMDB team, MONAView Spectrum
Experimental LC-MS/MSLC-MS/MS Spectrum - Luteolin 4'-glucoside 6V, Positive-QTOFsplash10-001i-0920000000-30158851ea6bb0efb8ab2021-09-20HMDB team, MONAView Spectrum
Experimental LC-MS/MSLC-MS/MS Spectrum - Luteolin 4'-glucoside 6V, Positive-QTOFsplash10-000j-0090500000-665f19757855b18ca9152021-09-20HMDB team, MONAView Spectrum
Experimental LC-MS/MSLC-MS/MS Spectrum - Luteolin 4'-glucoside 6V, Positive-QTOFsplash10-000i-0090200000-c77123c94eb48f949cc22021-09-20HMDB team, MONAView Spectrum
Experimental LC-MS/MSLC-MS/MS Spectrum - Luteolin 4'-glucoside 6V, Positive-QTOFsplash10-000i-0090000000-9591033be6d3fb72fa882021-09-20HMDB team, MONAView Spectrum
Experimental LC-MS/MSLC-MS/MS Spectrum - Luteolin 4'-glucoside 6V, Positive-QTOFsplash10-000j-0090400000-348aa5e019fb43587b7a2021-09-20HMDB team, MONAView Spectrum
Experimental LC-MS/MSLC-MS/MS Spectrum - Luteolin 4'-glucoside 6V, Positive-QTOFsplash10-001i-0910000000-feb6d6b3858619587da92021-09-20HMDB team, MONAView Spectrum
Experimental LC-MS/MSLC-MS/MS Spectrum - Luteolin 4'-glucoside 6V, Positive-QTOFsplash10-000i-0090000000-ad7e50e1d15ce9418f352021-09-20HMDB team, MONAView Spectrum
Experimental LC-MS/MSLC-MS/MS Spectrum - Luteolin 4'-glucoside 6V, Positive-QTOFsplash10-000i-0090000000-94520eb801456854823b2021-09-20HMDB team, MONAView Spectrum
Experimental LC-MS/MSLC-MS/MS Spectrum - Luteolin 4'-glucoside 6V, Positive-QTOFsplash10-000i-0090000000-b003696371443919aa6a2021-09-20HMDB team, MONAView Spectrum
Experimental LC-MS/MSLC-MS/MS Spectrum - Luteolin 4'-glucoside 6V, Positive-QTOFsplash10-000j-0090400000-cea122cba8dfcbe90f332021-09-20HMDB team, MONAView Spectrum
Experimental LC-MS/MSLC-MS/MS Spectrum - Luteolin 4'-glucoside 6V, Positive-QTOFsplash10-000i-0090000000-e81e47829a68440930072021-09-20HMDB team, MONAView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Luteolin 4'-glucoside 10V, Positive-QTOFsplash10-000j-0190700000-1578c227b41df380d9c12015-04-24Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Luteolin 4'-glucoside 20V, Positive-QTOFsplash10-000i-0190100000-3b6efbaa6b7ca2cd995a2015-04-24Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Luteolin 4'-glucoside 40V, Positive-QTOFsplash10-05n0-2790000000-5962588cabe4c28a4f0b2015-04-24Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Luteolin 4'-glucoside 10V, Positive-QTOFsplash10-000j-0190700000-1578c227b41df380d9c12015-04-24Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Luteolin 4'-glucoside 20V, Positive-QTOFsplash10-000i-0190100000-3b6efbaa6b7ca2cd995a2015-04-24Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Luteolin 4'-glucoside 40V, Positive-QTOFsplash10-05n0-2790000000-5962588cabe4c28a4f0b2015-04-24Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Luteolin 4'-glucoside 10V, Negative-QTOFsplash10-000b-0151900000-d37b85771ce55bd22b782015-04-25Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Luteolin 4'-glucoside 20V, Negative-QTOFsplash10-000i-1090200000-e25cf79ee7db2464c3682015-04-25Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Luteolin 4'-glucoside 40V, Negative-QTOFsplash10-000l-2390000000-a7b4978a7079e2429df42015-04-25Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Luteolin 4'-glucoside 10V, Negative-QTOFsplash10-000b-0151900000-d37b85771ce55bd22b782015-04-25Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Luteolin 4'-glucoside 20V, Negative-QTOFsplash10-000i-1090200000-e25cf79ee7db2464c3682015-04-25Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Luteolin 4'-glucoside 40V, Negative-QTOFsplash10-000l-2390000000-a7b4978a7079e2429df42015-04-25Wishart 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 IDFDB017827
KNApSAcK IDC00004276
Chemspider ID11446810
KEGG Compound IDNot Available
BioCyc IDNot Available
BiGG IDNot Available
Wikipedia LinkNot Available
METLIN IDNot Available
PubChem Compound12304737
PDB IDNot Available
ChEBI IDNot Available
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. (). Yannai, Shmuel. (2004) Dictionary of food compounds with CD-ROM: Additives, flavors, and ingredients. Boca Raton: Chapman & Hall/CRC.. .

Enzymes

Enzyme Details
1. UDP-glucuronosyltransferase 1-1
General function:
Involved in transferase activity, transferring hexosyl groups
Specific function:
UDPGT is of major importance in the conjugation and subsequent elimination of potentially toxic xenobiotics and endogenous compounds. This isoform glucuronidates bilirubin IX-alpha to form both the IX-alpha-C8 and IX-alpha-C12 monoconjugates and diconjugate. Is also able to catalyze the glucuronidation of 17beta-estradiol, 17alpha-ethinylestradiol, 1-hydroxypyrene, 4-methylumbelliferone, 1-naphthol, paranitrophenol, scopoletin, and umbelliferone.
Gene Name:
UGT1A1
Uniprot ID:
P22309
Molecular weight:
59590.91
Reactions
Luteolin 4'-glucoside → Luteolin 4'-glucoside 7-galacturonidedetails