Glycoside
GD001859
Name:
NoneFormula:
C23H23O5N2ClSmiles:
CC[C@@H]1O[C@H](c2ccc(Cl)c(Cc3cnc(-c4ccoc4)nc3)c2)[C@H](O)[C@H](O)[C@H]1OAglycone:
Clc1ccccc1Cc1cnc(-c2ccoc2)nc1Sugarmoiety:
CCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.36 |
| AlogP: | 2.91 | Num_rotatable_bonds: | 5 |
| MolWt: | 430.89 | Num_heavy_atoms: | 30 |
| TPSA: | 108.84 | NumAromaticRings: | 3 |
Unique Aglycone
AD01819
Formula: C16H11ON2Cl
Smiles:
Clc1ccccc1Cc1cnc(-c2ccoc2)nc1| HBA: | 3 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.07 |
| AlogP: | 3.98 | Num_rotatable_bonds: | 3 |
| MolWt: | 270.72 | Num_heavy_atoms: | 19 |
| TPSA: | 38.92 | NumAromaticRings: | 3 |
