Glycoside
GD117139
Name:
3,4,5-trihydroxy-6-[(7-methoxy-4-oxo-2-phenyl-4H-chromen-3-yl)oxy]oxane-2-carboxylic acidFormula:
C22H20O10Smiles:
COc1ccc2c(=O)c(OC3OC(C(=O)O)C(O)C(O)C3O)c(-c3ccccc3)oc2c1Aglycone:
COc1ccc2c(=O)c(O)c(-c3ccccc3)oc2c1Sugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.27 |
| AlogP: | 0.74 | Num_rotatable_bonds: | 5 |
| MolWt: | 444.39 | Num_heavy_atoms: | 32 |
| TPSA: | 155.89 | NumAromaticRings: | 3 |
Unique Aglycone
AD46657
Formula: C16H12O4
Smiles:
COc1ccc2c(=O)c(O)c(-c3ccccc3)oc2c1| HBA: | 4 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.06 |
| AlogP: | 3.17 | Num_rotatable_bonds: | 2 |
| MolWt: | 268.27 | Num_heavy_atoms: | 20 |
| TPSA: | 59.67 | NumAromaticRings: | 3 |
