Glycoside
GD065389
Name:
NoneFormula:
C14H18O7N3ClSmiles:
COC(=O)c1c(N[C@H]2[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)nnc(Cl)c1CAglycone:
COC(=O)c1c(N)nnc(Cl)c1CSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.62 |
| AlogP: | -1.56 | Num_rotatable_bonds: | 4 |
| MolWt: | 363.75 | Num_heavy_atoms: | 24 |
| TPSA: | 154.26 | NumAromaticRings: | 1 |
Unique Aglycone
AD31443
Formula: C8H8O2N3Cl
Smiles:
COC(=O)c1c(N)nnc(Cl)c1C| HBA: | 5 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.29 |
| AlogP: | 0.81 | Num_rotatable_bonds: | 1 |
| MolWt: | 201.61 | Num_heavy_atoms: | 13 |
| TPSA: | 78.1 | NumAromaticRings: | 1 |
