Glycoside
GD031798
Name:
NoneFormula:
C16H12O4N2Cl2Smiles:
C#C[C@@]1(O)[C@H](CO)O[C@H](n2cc(Cl)c3c(Cl)ccnc32)[C@H]1OAglycone:
ClC1=C[N]c2nccc(Cl)c21Sugarmoiety:
C#CC1(O)C(CO)OC(O)C1OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.36 |
| AlogP: | 0.96 | Num_rotatable_bonds: | 2 |
| MolWt: | 343.17 | Num_heavy_atoms: | 22 |
| TPSA: | 87.74 | NumAromaticRings: | 2 |
Unique Aglycone
AD20463
Formula: C9H3N2Cl2
Smiles:
ClC1=C[N]c2nccc(Cl)c21| HBA: | 2 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.0 |
| AlogP: | 2.52 | Num_rotatable_bonds: | 0 |
| MolWt: | 186.02 | Num_heavy_atoms: | 11 |
| TPSA: | 26.99 | NumAromaticRings: | 1 |
