Glycoside
GD003748
Name:
NoneFormula:
C14H14O6N2Cl2Smiles:
CCOC(=O)c1nc([C@@H]2O[C@H](CO)[C@H](O)[C@H]2O)c(Cl)nc1ClAglycone:
CCOC(=O)c1ncc(Cl)nc1ClSugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.58 |
| AlogP: | 0.11 | Num_rotatable_bonds: | 4 |
| MolWt: | 353.16 | Num_heavy_atoms: | 22 |
| TPSA: | 122.0 | NumAromaticRings: | 1 |
Unique Aglycone
AD03360
Formula: C9H6O2N2Cl2
Smiles:
CCOC(=O)c1ncc(Cl)nc1Cl| HBA: | 4 | RingCount: | 1 |
| HBD: | 0 | FractionCSP3: | 0.29 |
| AlogP: | 1.96 | Num_rotatable_bonds: | 2 |
| MolWt: | 221.04 | Num_heavy_atoms: | 13 |
| TPSA: | 52.08 | NumAromaticRings: | 1 |
