Glycoside
GD079054
Name:
NoneFormula:
C21H20O7Smiles:
CC(=O)O[C@@H]1O[C@H](C)[C@@H](OC(=O)c2ccccc2)[C@@H]1OC(=O)c1ccccc1Aglycone:
O=C(O)c1ccccc1.O=C(O)c1ccccc1Sugarmoiety:
CC(=O)OC1OC(C)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.29 |
| AlogP: | 2.75 | Num_rotatable_bonds: | 5 |
| MolWt: | 384.38 | Num_heavy_atoms: | 28 |
| TPSA: | 88.13 | NumAromaticRings: | 2 |
Unique Aglycone
AD00002
Formula: C7H6O2
Smiles:
O=C(O)c1ccccc1| HBA: | 2 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 1.38 | Num_rotatable_bonds: | 1 |
| MolWt: | 122.12 | Num_heavy_atoms: | 9 |
| TPSA: | 37.3 | NumAromaticRings: | 1 |
