Glycoside
GD007591
Name:
NoneFormula:
C15H18O6N3FSmiles:
OC[C@@H]1O[C@H](OCc2cn(-c3ccc(F)cc3)nn2)[C@H](O)[C@H](O)[C@H]1OAglycone:
OCc1cn(-c2ccc(F)cc2)nn1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.47 |
| AlogP: | -1.28 | Num_rotatable_bonds: | 5 |
| MolWt: | 355.32 | Num_heavy_atoms: | 25 |
| TPSA: | 130.09 | NumAromaticRings: | 2 |
Unique Aglycone
AD06161
Formula: C9H8ON3F
Smiles:
OCc1cn(-c2ccc(F)cc2)nn1| HBA: | 4 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.11 |
| AlogP: | 0.9 | Num_rotatable_bonds: | 2 |
| MolWt: | 193.18 | Num_heavy_atoms: | 14 |
| TPSA: | 50.94 | NumAromaticRings: | 2 |
