Glycoside

GD152988
Name:
4-[2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,4-dihydro-2H-1-benzopyran-8-yl]-2-(4-hydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-3,5,7-triolFormula:
C36H36O16Smiles:
OCC1OC(OC2Cc3c(O)cc(O)c(C4c5c(O)cc(O)cc5OC(c5ccc(O)cc5)C4O)c3OC2c2ccc(O)c(O)c2)C(O)C(O)C1OAglycone:
Oc1ccc(C2Oc3cc(O)cc(O)c3C(c3c(O)cc(O)c4c3OC(c3ccc(O)c(O)c3)C(O)C4)C2O)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
HBA: | 16 | RingCount: | 7 |
HBD: | 12 | FractionCSP3: | 0.33 |
AlogP: | 1.11 | Num_rotatable_bonds: | 6 |
MolWt: | 724.67 | Num_heavy_atoms: | 52 |
TPSA: | 279.68 | NumAromaticRings: | 4 |
Unique Aglycone
AD58190
Formula: C30H26O11
Smiles:
Oc1ccc(C2Oc3cc(O)cc(O)c3C(c3c(O)cc(O)c4c3OC(c3ccc(O)c(O)c3)C(O)C4)C2O)cc1HBA: | 11 | RingCount: | 6 |
HBD: | 9 | FractionCSP3: | 0.2 |
AlogP: | 3.29 | Num_rotatable_bonds: | 3 |
MolWt: | 562.53 | Num_heavy_atoms: | 41 |
TPSA: | 200.53 | NumAromaticRings: | 4 |