Glycoside
GD000721
Name:
NoneFormula:
C21H22O6N3ClSmiles:
Cc1cccc2nn(Cc3cc([C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)ccc3Cl)c(=O)n12Aglycone:
Cc1cccc2nn(Cc3ccccc3Cl)c(=O)n12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.4 |
| AlogP: | 0.02 | Num_rotatable_bonds: | 4 |
| MolWt: | 435.86 | Num_heavy_atoms: | 30 |
| TPSA: | 129.45 | NumAromaticRings: | 3 |
Unique Aglycone
AD00770
Formula: C15H12ON3Cl
Smiles:
Cc1cccc2nn(Cc3ccccc3Cl)c(=O)n12| HBA: | 4 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.14 |
| AlogP: | 2.51 | Num_rotatable_bonds: | 2 |
| MolWt: | 273.72 | Num_heavy_atoms: | 19 |
| TPSA: | 39.3 | NumAromaticRings: | 3 |
