Glycoside
GD143386
Name:
2-(hydroxymethyl)-6-{[2-methoxy-3-(6-methoxy-2H-1,3-benzodioxol-5-yl)-2H-chromen-7-yl]oxy}oxane-3,4,5-triolFormula:
C24H26O11Smiles:
COc1cc2c(cc1C1=Cc3ccc(OC4OC(CO)C(O)C(O)C4O)cc3OC1OC)OCO2Aglycone:
COc1cc2c(cc1C1=Cc3ccc(O)cc3OC1OC)OCO2Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.42 |
| AlogP: | 0.51 | Num_rotatable_bonds: | 6 |
| MolWt: | 490.46 | Num_heavy_atoms: | 35 |
| TPSA: | 145.53 | NumAromaticRings: | 2 |
Unique Aglycone
AD57674
Formula: C18H16O6
Smiles:
COc1cc2c(cc1C1=Cc3ccc(O)cc3OC1OC)OCO2| HBA: | 6 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.22 |
| AlogP: | 3.04 | Num_rotatable_bonds: | 3 |
| MolWt: | 328.32 | Num_heavy_atoms: | 24 |
| TPSA: | 66.38 | NumAromaticRings: | 2 |
