Glycoside
GD017154
Name:
NoneFormula:
C20H20O6N3ClSmiles:
Cn1cnc2cc(-c3ccc(O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)c(Cl)c3)cnc21Aglycone:
Cn1cnc2cc(-c3ccc(O)c(Cl)c3)cnc21Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.37 |
| AlogP: | 0.47 | Num_rotatable_bonds: | 4 |
| MolWt: | 421.84 | Num_heavy_atoms: | 29 |
| TPSA: | 130.09 | NumAromaticRings: | 3 |
Unique Aglycone
AD12276
Formula: C14H10ON3Cl
Smiles:
Cn1cnc2cc(-c3ccc(O)c(Cl)c3)cnc21| HBA: | 4 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.08 |
| AlogP: | 2.99 | Num_rotatable_bonds: | 1 |
| MolWt: | 259.7 | Num_heavy_atoms: | 18 |
| TPSA: | 50.94 | NumAromaticRings: | 3 |
