Glycoside
GD061728
Name:
NoneFormula:
C16H23O5NClSmiles:
C[C@H](Cc1ccc(Cl)cc1)[NH2+][C@@H](C=O)[C@@H](O)[C@H](O)[C@H](O)COAglycone:
CC([NH3+])Cc1ccc(Cl)cc1Sugarmoiety:
O=CC([OH2+])C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 6 | RingCount: | 1 |
| HBD: | 6 | FractionCSP3: | 0.53 |
| AlogP: | -1.52 | Num_rotatable_bonds: | 9 |
| MolWt: | 332.8 | Num_heavy_atoms: | 22 |
| TPSA: | 114.6 | NumAromaticRings: | 1 |
Unique Aglycone
AD30135
Formula: C10H13NCl
Smiles:
CC([NH3+])Cc1ccc(Cl)cc1| HBA: | 1 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.33 |
| AlogP: | 1.51 | Num_rotatable_bonds: | 2 |
| MolWt: | 170.66 | Num_heavy_atoms: | 11 |
| TPSA: | 27.64 | NumAromaticRings: | 1 |
