Glycoside
GD037834
Name:
propyl 2-(acetylamino)-4-o-{3-o-[(1-benzyl-1h-1,2,3-triazol-4-yl)methyl]-beta-d-galactopyranosyl}-2-deoxy-beta-d-glucopyranosideFormula:
C27H40O11N4Smiles:
CCCO[C@H]1O[C@H](CO)[C@H](O[C@H]2O[C@H](CO)[C@H](O)[C@H](OCc3cn(Cc4ccccc4)nn3)[C@@H]2O)[C@H](O)[C@@H]1NC(C)=OAglycone:
OCc1cn(Cc2ccccc2)nn1Sugarmoiety:
CCCOC1OC(CO)C(OC2OC(CO)C(O)C(O)C2O)C(O)C1NC(C)=OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.67 |
| AlogP: | -1.95 | Num_rotatable_bonds: | 13 |
| MolWt: | 596.63 | Num_heavy_atoms: | 42 |
| TPSA: | 207.11 | NumAromaticRings: | 2 |
Unique Aglycone
AD16373
Formula: C10H11ON3
Smiles:
OCc1cn(Cc2ccccc2)nn1| HBA: | 4 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.2 |
| AlogP: | 0.82 | Num_rotatable_bonds: | 3 |
| MolWt: | 189.22 | Num_heavy_atoms: | 14 |
| TPSA: | 50.94 | NumAromaticRings: | 2 |
