Glycoside
GD048270
Name:
NoneFormula:
C13H16O7N2Smiles:
CC(=O)c1ncccc1NC(=O)C(=O)[C@H](O)[C@@H](O)[C@H](O)COAglycone:
CC(=O)c1ncccc1NSugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.38 |
| AlogP: | -2.13 | Num_rotatable_bonds: | 7 |
| MolWt: | 312.28 | Num_heavy_atoms: | 22 |
| TPSA: | 157.05 | NumAromaticRings: | 1 |
Unique Aglycone
AD25852
Formula: C7H8ON2
Smiles:
CC(=O)c1ncccc1N| HBA: | 3 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.14 |
| AlogP: | 0.87 | Num_rotatable_bonds: | 1 |
| MolWt: | 136.15 | Num_heavy_atoms: | 10 |
| TPSA: | 55.98 | NumAromaticRings: | 1 |
