Glycoside
GD048737
Name:
NoneFormula:
C15H18O6N2Smiles:
Cn1ccc2cc(NC(=O)C(=O)[C@H](O)[C@@H](O)[C@@H](O)CO)ccc21Aglycone:
Cn1ccc2cc(N)ccc21Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.33 |
| AlogP: | -1.24 | Num_rotatable_bonds: | 6 |
| MolWt: | 322.32 | Num_heavy_atoms: | 23 |
| TPSA: | 132.02 | NumAromaticRings: | 2 |
Unique Aglycone
AD25949
Formula: C9H10N2
Smiles:
Cn1ccc2cc(N)ccc21| HBA: | 2 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.11 |
| AlogP: | 1.76 | Num_rotatable_bonds: | 0 |
| MolWt: | 146.19 | Num_heavy_atoms: | 11 |
| TPSA: | 30.95 | NumAromaticRings: | 2 |
