Glycoside
GD036084
Name:
NoneFormula:
C20H21O7N2ClSmiles:
COC(=O)c1ccc(Cc2cc([C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)ccc2Cl)nn1Aglycone:
COC(=O)c1ccc(Cc2ccccc2Cl)nn1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.42 |
| AlogP: | 0.02 | Num_rotatable_bonds: | 5 |
| MolWt: | 424.84 | Num_heavy_atoms: | 29 |
| TPSA: | 142.23 | NumAromaticRings: | 2 |
Unique Aglycone
AD22793
Formula: C14H11O2N2Cl
Smiles:
COC(=O)c1ccc(Cc2ccccc2Cl)nn1| HBA: | 4 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.15 |
| AlogP: | 2.51 | Num_rotatable_bonds: | 3 |
| MolWt: | 262.7 | Num_heavy_atoms: | 18 |
| TPSA: | 52.08 | NumAromaticRings: | 2 |
