Glycoside
GD017764
Name:
NoneFormula:
C27H38O17Smiles:
COC(=O)[C@@H](O[C@@H]1O[C@H](CO)[C@H](O)[C@H](O[C@H](Cc2ccccc2)C(=O)O)[C@H]1O)[C@@H](O[C@@H]1O[C@H](C)[C@H](O)[C@H](O)[C@H]1O)C(=O)OCAglycone:
O=C(O)C(O)Cc1ccccc1Sugarmoiety:
COC(=O)C(OC1OC(C)C(O)C(O)C1O)C(OC1OC(CO)C(O)C(O)C1O)C(=O)OCOther Identifiers
Properties
| HBA: | 17 | RingCount: | 3 |
| HBD: | 7 | FractionCSP3: | 0.67 |
| AlogP: | -3.55 | Num_rotatable_bonds: | 13 |
| MolWt: | 634.58 | Num_heavy_atoms: | 44 |
| TPSA: | 257.43 | NumAromaticRings: | 1 |
Unique Aglycone
AD00001
Formula: C9H10O3
Smiles:
O=C(O)C(O)Cc1ccccc1| HBA: | 3 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.22 |
| AlogP: | 0.67 | Num_rotatable_bonds: | 3 |
| MolWt: | 166.18 | Num_heavy_atoms: | 12 |
| TPSA: | 57.53 | NumAromaticRings: | 1 |
