Glycoside
GD014398
Name:
NoneFormula:
C24H18O5N3ClSmiles:
OC[C@@H]1O[C@H](n2c3ccc(Cl)cc3c3c(-c4cc5ccccc5o4)ncnc32)[C@H](O)[C@H]1OAglycone:
Clc1ccc2c(c1)-c1c(ncnc1-c1cc3ccccc3o1)[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 6 |
| HBD: | 3 | FractionCSP3: | 0.22 |
| AlogP: | 3.26 | Num_rotatable_bonds: | 3 |
| MolWt: | 451.87 | Num_heavy_atoms: | 32 |
| TPSA: | 113.77 | NumAromaticRings: | 5 |
Unique Aglycone
AD10590
Formula: C19H9ON3Cl
Smiles:
Clc1ccc2c(c1)-c1c(ncnc1-c1cc3ccccc3o1)[N]2| HBA: | 4 | RingCount: | 5 |
| HBD: | 0 | FractionCSP3: | 0.0 |
| AlogP: | 5.09 | Num_rotatable_bonds: | 1 |
| MolWt: | 318.74 | Num_heavy_atoms: | 23 |
| TPSA: | 53.02 | NumAromaticRings: | 4 |
