Glycoside
GD116679
Name:
9-methoxy-7-{2-[(3,4,5-trihydroxyoxan-2-yl)oxy]phenyl}-2H,8H-[1,3]dioxolo[4,5-g]chromen-8-oneFormula:
C22H20O10Smiles:
COc1c2c(cc3occ(-c4ccccc4OC4OCC(O)C(O)C4O)c(=O)c13)OCO2Aglycone:
COc1c2c(cc3occ(-c4ccccc4O)c(=O)c13)OCO2Sugarmoiety:
OC1COC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 5 |
| HBD: | 3 | FractionCSP3: | 0.32 |
| AlogP: | 1.02 | Num_rotatable_bonds: | 4 |
| MolWt: | 444.39 | Num_heavy_atoms: | 32 |
| TPSA: | 137.05 | NumAromaticRings: | 3 |
Unique Aglycone
AD46378
Formula: C17H12O6
Smiles:
COc1c2c(cc3occ(-c4ccccc4O)c(=O)c13)OCO2| HBA: | 6 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.12 |
| AlogP: | 2.9 | Num_rotatable_bonds: | 2 |
| MolWt: | 312.28 | Num_heavy_atoms: | 23 |
| TPSA: | 78.13 | NumAromaticRings: | 3 |
