Glycoside
GD015829
Name:
NoneFormula:
C15H18O8N4Smiles:
O=[N+]([O-])c1ccc(-n2cc(CO[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)nn2)cc1Aglycone:
O=[N+]([O-])c1ccc(-n2cc(CO)nn2)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.47 |
| AlogP: | -1.51 | Num_rotatable_bonds: | 6 |
| MolWt: | 382.33 | Num_heavy_atoms: | 27 |
| TPSA: | 173.23 | NumAromaticRings: | 2 |
Unique Aglycone
AD11456
Formula: C9H8O3N4
Smiles:
O=[N+]([O-])c1ccc(-n2cc(CO)nn2)cc1| HBA: | 7 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.11 |
| AlogP: | 0.67 | Num_rotatable_bonds: | 3 |
| MolWt: | 220.19 | Num_heavy_atoms: | 16 |
| TPSA: | 94.08 | NumAromaticRings: | 2 |
