Glycoside
GD000467
Name:
NoneFormula:
C19H13O4N2Cl3Smiles:
OC[C@@H]1OC(n2c(Cl)nc3cc4cc(Cl)c(Cl)cc4cc32)[C@H](O)[C@H]1OAglycone:
ClC1=Nc2cc3cc(Cl)c(Cl)cc3cc2[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.31 |
| AlogP: | 2.76 | Num_rotatable_bonds: | 2 |
| MolWt: | 403.65 | Num_heavy_atoms: | 25 |
| TPSA: | 87.74 | NumAromaticRings: | 3 |
Unique Aglycone
AD00524
Formula: C14H4N2Cl3
Smiles:
ClC1=Nc2cc3cc(Cl)c(Cl)cc3cc2[N]1| HBA: | 2 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.0 |
| AlogP: | 4.62 | Num_rotatable_bonds: | 0 |
| MolWt: | 270.53 | Num_heavy_atoms: | 16 |
| TPSA: | 26.46 | NumAromaticRings: | 2 |
