Glycoside
GD106035
Name:
3,5-dihydroxy-2-[(6-methoxy-2-oxo-2H-chromen-7-yl)oxy]-6-{[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]methyl}oxan-4-yl acetateFormula:
C24H30O14Smiles:
COc1cc2ccc(=O)oc2cc1O[C@@H]1O[C@H](CO[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O)[C@@H](O)[C@H](OC(C)=O)[C@H]1OAglycone:
COc1cc2ccc(=O)oc2cc1OSugarmoiety:
CC(=O)OC1C(O)C(O)OC(COC2OC(C)C(O)C(O)C2O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.58 |
| AlogP: | -1.6 | Num_rotatable_bonds: | 7 |
| MolWt: | 542.49 | Num_heavy_atoms: | 38 |
| TPSA: | 203.81 | NumAromaticRings: | 2 |
Unique Aglycone
AD09078
Formula: C10H8O4
Smiles:
COc1cc2ccc(=O)oc2cc1O| HBA: | 4 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.1 |
| AlogP: | 1.51 | Num_rotatable_bonds: | 1 |
| MolWt: | 192.17 | Num_heavy_atoms: | 14 |
| TPSA: | 59.67 | NumAromaticRings: | 2 |
