Glycoside

GD152503
Name:
4,5-dihydroxy-2-(hydroxymethyl)-6-(4-hydroxyphenoxy)oxan-3-yl 3-(3,4-dihydroxyphenyl)prop-2-enoateFormula:
C21H22O10Smiles:
O=C(C=Cc1ccc(O)c(O)c1)OC1C(CO)OC(Oc2ccc(O)cc2)C(O)C1OAglycone:
O=C(O)C=Cc1ccc(O)c(O)c1.Oc1ccc(O)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
HBA: | 10 | RingCount: | 3 |
HBD: | 6 | FractionCSP3: | 0.29 |
AlogP: | 0.25 | Num_rotatable_bonds: | 6 |
MolWt: | 434.4 | Num_heavy_atoms: | 31 |
TPSA: | 166.14 | NumAromaticRings: | 2 |
Unique Aglycone
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 |
AD00519
Formula: C6H6O2
Smiles:
Oc1ccc(O)cc1HBA: | 2 | RingCount: | 1 |
HBD: | 2 | FractionCSP3: | 0.0 |
AlogP: | 1.1 | Num_rotatable_bonds: | 0 |
MolWt: | 110.11 | Num_heavy_atoms: | 8 |
TPSA: | 40.46 | NumAromaticRings: | 1 |