Glycoside
GD051316
Name:
methyl 2-{4-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]phenyl}acetateFormula:
C15H20O7Smiles:
COC(=O)Cc1ccc(O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2O)cc1Aglycone:
COC(=O)Cc1ccc(O)cc1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.53 |
| AlogP: | -0.39 | Num_rotatable_bonds: | 4 |
| MolWt: | 312.32 | Num_heavy_atoms: | 22 |
| TPSA: | 105.45 | NumAromaticRings: | 1 |
Unique Aglycone
AD02427
Formula: C9H10O3
Smiles:
COC(=O)Cc1ccc(O)cc1| HBA: | 3 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.22 |
| AlogP: | 1.11 | Num_rotatable_bonds: | 2 |
| MolWt: | 166.18 | Num_heavy_atoms: | 12 |
| TPSA: | 46.53 | NumAromaticRings: | 1 |
