Glycoside
GD009418
Name:
NoneFormula:
C14H18O6N4Smiles:
OC[C@@H]1O[C@H](OCc2cn(-c3ccncc3)nn2)[C@H](O)[C@H](O)[C@H]1OAglycone:
OCc1cn(-c2ccncc2)nn1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.5 |
| AlogP: | -2.02 | Num_rotatable_bonds: | 5 |
| MolWt: | 338.32 | Num_heavy_atoms: | 24 |
| TPSA: | 142.98 | NumAromaticRings: | 2 |
Unique Aglycone
AD07386
Formula: C8H8ON4
Smiles:
OCc1cn(-c2ccncc2)nn1| HBA: | 5 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.12 |
| AlogP: | 0.15 | Num_rotatable_bonds: | 2 |
| MolWt: | 176.18 | Num_heavy_atoms: | 13 |
| TPSA: | 63.83 | NumAromaticRings: | 2 |
