Glycoside
GD038105
Name:
2-deoxy-2-{[(2e)-3-(3,4-dichlorophenyl)prop-2-enoyl]amino}-alpha-d-glucopyranoseFormula:
C17H17O6NCl2Smiles:
O=C(C=Cc1ccc(Cl)c(Cl)c1)N[C@H]1[C@H](O)O[C@H](CO)[C@H](O)[C@@H]1OAglycone:
NC(=O)C=Cc1ccc(Cl)c(Cl)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.4 |
| AlogP: | -0.08 | Num_rotatable_bonds: | 4 |
| MolWt: | 378.21 | Num_heavy_atoms: | 24 |
| TPSA: | 119.25 | NumAromaticRings: | 1 |
Unique Aglycone
AD08436
Formula: C11H7ONCl2
Smiles:
NC(=O)C=Cc1ccc(Cl)c(Cl)c1| HBA: | 2 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 2.49 | Num_rotatable_bonds: | 2 |
| MolWt: | 216.07 | Num_heavy_atoms: | 13 |
| TPSA: | 43.09 | NumAromaticRings: | 1 |
