Glycoside
GD057064
Name:
NoneFormula:
C15H16O6N4Smiles:
Cn1cc2cccc(-c3noc(C(=O)[C@H](O)[C@H](O)[C@H](O)CO)n3)c2n1Aglycone:
Cn1cc2cccc(-c3ncon3)c2n1Sugarmoiety:
O=C(O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.33 |
| AlogP: | -1.12 | Num_rotatable_bonds: | 6 |
| MolWt: | 348.32 | Num_heavy_atoms: | 25 |
| TPSA: | 154.73 | NumAromaticRings: | 3 |
Unique Aglycone
AD28632
Formula: C10H8ON4
Smiles:
Cn1cc2cccc(-c3ncon3)c2n1| HBA: | 5 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.1 |
| AlogP: | 1.62 | Num_rotatable_bonds: | 1 |
| MolWt: | 200.2 | Num_heavy_atoms: | 15 |
| TPSA: | 56.74 | NumAromaticRings: | 3 |
