Glycoside
GD073905
Name:
NoneFormula:
C14H21O9N3Smiles:
COC(=O)C(Cc1cn([C@H]2[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)nn1)C(=O)OCAglycone:
COC(=O)C(CC1=C[N]N=N1)C(=O)OCSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.71 |
| AlogP: | -3.24 | Num_rotatable_bonds: | 6 |
| MolWt: | 375.33 | Num_heavy_atoms: | 26 |
| TPSA: | 173.46 | NumAromaticRings: | 1 |
Unique Aglycone
AD34167
Formula: C8H10O4N3
Smiles:
COC(=O)C(CC1=C[N]N=N1)C(=O)OC| HBA: | 7 | RingCount: | 1 |
| HBD: | 0 | FractionCSP3: | 0.5 |
| AlogP: | 0.17 | Num_rotatable_bonds: | 4 |
| MolWt: | 212.18 | Num_heavy_atoms: | 15 |
| TPSA: | 91.42 | NumAromaticRings: | 0 |
