Glycoside
GD040321
Name:
(2s)-2-[[(2r)-2-[(2s,3r,4r,5s,6r)-3-acetamido-2,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxypropanoyl]amino]propanoic acidFormula:
C14H24O9N2Smiles:
CC(=O)N[C@H]1[C@@H](O)O[C@@H](CO)[C@@H](O)[C@@H]1O[C@@H](C)C(=O)N[C@H](C)C(=O)OAglycone:
CC(O)C(=O)NC(C)C(=O)OSugarmoiety:
CC(=O)NC1C(O)OC(CO)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 1 |
| HBD: | 6 | FractionCSP3: | 0.79 |
| AlogP: | -3.08 | Num_rotatable_bonds: | 7 |
| MolWt: | 364.35 | Num_heavy_atoms: | 25 |
| TPSA: | 174.65 | NumAromaticRings: | 0 |
Unique Aglycone
AD24724
Formula: C6H11O4N
Smiles:
CC(O)C(=O)NC(C)C(=O)O| HBA: | 5 | RingCount: | 0 |
| HBD: | 3 | FractionCSP3: | 0.67 |
| AlogP: | -1.04 | Num_rotatable_bonds: | 3 |
| MolWt: | 161.16 | Num_heavy_atoms: | 11 |
| TPSA: | 86.63 | NumAromaticRings: | 0 |
