Glycoside
GD038813
Name:
methyl 2-acetamido-4-o-{2-acetamido-4,6-o-[(1s)-1-carboxyethylidene]-2-deoxy-beta-d-mannopyranosyl}-2-deoxy-beta-d-glucopyranosideFormula:
C20H32O13N2Smiles:
CO[C@@H]1O[C@H](CO)[C@@H](O[C@@H]2O[C@H]3CO[C@](C)(C(=O)O)O[C@@H]3[C@H](O)[C@H]2NC(C)=O)[C@H](O)[C@@H]1NC(C)=OAglycone:
CC(=O)NC1C(O)OC2COC(C)(C(=O)O)OC2C1OSugarmoiety:
COC1OC(CO)C(O)C(O)C1NC(C)=OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.85 |
| AlogP: | -3.59 | Num_rotatable_bonds: | 7 |
| MolWt: | 508.48 | Num_heavy_atoms: | 35 |
| TPSA: | 211.57 | NumAromaticRings: | 0 |
Unique Aglycone
AD24146
Formula: C11H17O8N
Smiles:
CC(=O)NC1C(O)OC2COC(C)(C(=O)O)OC2C1O| HBA: | 9 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.82 |
| AlogP: | -2.21 | Num_rotatable_bonds: | 2 |
| MolWt: | 291.26 | Num_heavy_atoms: | 20 |
| TPSA: | 134.55 | NumAromaticRings: | 0 |
