Glycoside
GD051810
Name:
NoneFormula:
C14H16O6N2Smiles:
O[C@H]1[C@@H](O)[C@@H](c2nnc(Cc3ccccc3)o2)O[C@@H](O)[C@@H]1OAglycone:
c1ccc(Cc2nnco2)cc1Sugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.43 |
| AlogP: | -0.87 | Num_rotatable_bonds: | 3 |
| MolWt: | 308.29 | Num_heavy_atoms: | 22 |
| TPSA: | 129.07 | NumAromaticRings: | 2 |
Unique Aglycone
AD11225
Formula: C9H8ON2
Smiles:
c1ccc(Cc2nnco2)cc1| HBA: | 3 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.11 |
| AlogP: | 1.66 | Num_rotatable_bonds: | 2 |
| MolWt: | 160.18 | Num_heavy_atoms: | 12 |
| TPSA: | 38.92 | NumAromaticRings: | 2 |
