Glycoside
GD081050
Name:
NoneFormula:
C17H27O9N3Smiles:
CCOC(=O)C(CCc1cn([C@H]2[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)nn1)C(=O)OCCAglycone:
CCOC(=O)C(CCC1=C[N]N=N1)C(=O)OCCSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.76 |
| AlogP: | -2.07 | Num_rotatable_bonds: | 9 |
| MolWt: | 417.42 | Num_heavy_atoms: | 29 |
| TPSA: | 173.46 | NumAromaticRings: | 1 |
Unique Aglycone
AD36554
Formula: C11H16O4N3
Smiles:
CCOC(=O)C(CCC1=C[N]N=N1)C(=O)OCC| HBA: | 7 | RingCount: | 1 |
| HBD: | 0 | FractionCSP3: | 0.64 |
| AlogP: | 1.34 | Num_rotatable_bonds: | 7 |
| MolWt: | 254.27 | Num_heavy_atoms: | 18 |
| TPSA: | 91.42 | NumAromaticRings: | 0 |
