Glycoside
GD040116
Name:
5-(acetylamino)-3,5-dideoxynon-2-ulopyranonosyl-(2->3)-beta-d-lyxo-hexopyranosyl-(1->4)hexopyranoseFormula:
C23H39O19NSmiles:
CC(=O)N[C@@H]1[C@@H](O)C[C@@](O[C@H]2[C@H](O)[C@H](O[C@@H]3[C@@H](CO)O[C@@H](O)[C@@H](O)[C@H]3O)O[C@H](CO)[C@@H]2O)(C(=O)O)O[C@H]1[C@@H](O)[C@@H](O)COAglycone:
CC(=O)NC1C(O)CC(O)(C(=O)O)OC1C(O)C(O)COSugarmoiety:
OCC1OC(OC2C(CO)OC(O)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 20 | RingCount: | 3 |
| HBD: | 13 | FractionCSP3: | 0.91 |
| AlogP: | -8.22 | Num_rotatable_bonds: | 11 |
| MolWt: | 633.55 | Num_heavy_atoms: | 43 |
| TPSA: | 335.08 | NumAromaticRings: | 0 |
Unique Aglycone
AD00077
Formula: C11H19O9N
Smiles:
CC(=O)NC1C(O)CC(O)(C(=O)O)OC1C(O)C(O)CO| HBA: | 10 | RingCount: | 1 |
| HBD: | 7 | FractionCSP3: | 0.82 |
| AlogP: | -3.87 | Num_rotatable_bonds: | 5 |
| MolWt: | 309.27 | Num_heavy_atoms: | 21 |
| TPSA: | 176.78 | NumAromaticRings: | 0 |
