Glycoside
GD031319
Name:
Ascr#5Formula:
C9H16O6Smiles:
C[C@@H]1O[C@H](OCCC(=O)O)[C@H](O)C[C@H]1OAglycone:
O=C(O)CCOSugarmoiety:
CC1OC(O)C(O)CC1OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.89 |
| AlogP: | -0.67 | Num_rotatable_bonds: | 4 |
| MolWt: | 220.22 | Num_heavy_atoms: | 15 |
| TPSA: | 96.22 | NumAromaticRings: | 0 |
Unique Aglycone
AD20191
Formula: C3H6O3
Smiles:
O=C(O)CCO| HBA: | 3 | RingCount: | 0 |
| HBD: | 2 | FractionCSP3: | 0.67 |
| AlogP: | -0.55 | Num_rotatable_bonds: | 2 |
| MolWt: | 90.08 | Num_heavy_atoms: | 6 |
| TPSA: | 57.53 | NumAromaticRings: | 0 |
