Glycoside
GD110827
Name:
NoneFormula:
C28H26O10N2Cl2Smiles:
CC(=O)O[C@H](C(=O)Nc1ccccc1Cl)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H](OC(C)=O)C(=O)Nc1ccccc1ClAglycone:
Nc1ccccc1Cl.Nc1ccccc1ClSugarmoiety:
CC(=O)OC(C(=O)O)C(OC(C)=O)C(OC(C)=O)C(OC(C)=O)C(=O)OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.31 |
| AlogP: | 3.3 | Num_rotatable_bonds: | 11 |
| MolWt: | 597.4 | Num_heavy_atoms: | 40 |
| TPSA: | 163.4 | NumAromaticRings: | 2 |
Unique Aglycone
AD20225
Formula: C7H6NCl
Smiles:
Nc1ccccc1Cl| HBA: | 1 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 1.92 | Num_rotatable_bonds: | 0 |
| MolWt: | 127.57 | Num_heavy_atoms: | 8 |
| TPSA: | 26.02 | NumAromaticRings: | 1 |
