Glycoside
GD039107
Name:
n-[(2s)-6-amino-1-oxo-1-(pyrrolidin-1-yl)hexan-2-yl]-4-(beta-d-galactopyranosyloxy)benzamideFormula:
C23H35O8N3Smiles:
NCCCC[C@@H](NC(=O)c1ccc(O[C@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@@H]2O)cc1)C(=O)N1CCCC1Aglycone:
NCCCCC(NC(=O)c1ccc(O)cc1)C(=O)N1CCCC1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 7 | FractionCSP3: | 0.65 |
| AlogP: | -1.28 | Num_rotatable_bonds: | 10 |
| MolWt: | 481.55 | Num_heavy_atoms: | 34 |
| TPSA: | 174.81 | NumAromaticRings: | 1 |
Unique Aglycone
AD24286
Formula: C17H25O3N3
Smiles:
NCCCCC(NC(=O)c1ccc(O)cc1)C(=O)N1CCCC1| HBA: | 6 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.53 |
| AlogP: | 1.24 | Num_rotatable_bonds: | 7 |
| MolWt: | 319.41 | Num_heavy_atoms: | 23 |
| TPSA: | 95.66 | NumAromaticRings: | 1 |
