Glycoside
GD026963
Name:
methyl 6-[(5,7-dihydroxy-4-oxo-2-phenyl-4H-chromen-8-yl)oxy]-3,4,5-trihydroxyoxane-2-carboxylateFormula:
C22H20O11Smiles:
COC(=O)[C@@H]1O[C@H](Oc2c(O)cc(O)c3c(=O)cc(-c4ccccc4)oc23)[C@H](O)[C@H](O)[C@H]1OAglycone:
O=c1cc(-c2ccccc2)oc2c(O)c(O)cc(O)c12Sugarmoiety:
COC(=O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.27 |
| AlogP: | 0.23 | Num_rotatable_bonds: | 4 |
| MolWt: | 460.39 | Num_heavy_atoms: | 33 |
| TPSA: | 176.12 | NumAromaticRings: | 3 |
Unique Aglycone
AD17748
Formula: C15H10O5
Smiles:
O=c1cc(-c2ccccc2)oc2c(O)c(O)cc(O)c12| HBA: | 5 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | 2.58 | Num_rotatable_bonds: | 1 |
| MolWt: | 270.24 | Num_heavy_atoms: | 20 |
| TPSA: | 90.9 | NumAromaticRings: | 3 |
