Glycoside

GD148570
Name:
4,5-dihydroxy-6-(hydroxymethyl)-2-{[3-(4-hydroxyphenyl)prop-2-enoyl]oxy}oxan-3-yl 3-(3,4-dihydroxyphenyl)prop-2-enoateFormula:
C24H24O11Smiles:
O=C(C=Cc1ccc(O)cc1)OC1OC(CO)C(O)C(O)C1OC(=O)C=Cc1ccc(O)c(O)c1Aglycone:
O=C(O)C=Cc1ccc(O)c(O)c1.O=C(O)C=Cc1ccc(O)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
HBA: | 11 | RingCount: | 3 |
HBD: | 6 | FractionCSP3: | 0.25 |
AlogP: | 0.42 | Num_rotatable_bonds: | 7 |
MolWt: | 488.45 | Num_heavy_atoms: | 35 |
TPSA: | 183.21 | NumAromaticRings: | 2 |
Unique Aglycone
AD00021
Formula: C9H8O3
Smiles:
O=C(O)C=Cc1ccc(O)cc1HBA: | 3 | RingCount: | 1 |
HBD: | 2 | FractionCSP3: | 0.0 |
AlogP: | 1.49 | Num_rotatable_bonds: | 2 |
MolWt: | 164.16 | Num_heavy_atoms: | 12 |
TPSA: | 57.53 | NumAromaticRings: | 1 |
AD00127
Formula: C9H8O4
Smiles:
O=C(O)C=Cc1ccc(O)c(O)c1HBA: | 4 | RingCount: | 1 |
HBD: | 3 | FractionCSP3: | 0.0 |
AlogP: | 1.2 | Num_rotatable_bonds: | 2 |
MolWt: | 180.16 | Num_heavy_atoms: | 13 |
TPSA: | 77.76 | NumAromaticRings: | 1 |