Glycoside
GD065700
Name:
NoneFormula:
C14H18O7N3ClSmiles:
CCOC(=O)c1nnc(Cl)cc1N[C@H]1[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]1OAglycone:
CCOC(=O)c1nnc(Cl)cc1NSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.62 |
| AlogP: | -1.48 | Num_rotatable_bonds: | 5 |
| MolWt: | 363.75 | Num_heavy_atoms: | 24 |
| TPSA: | 154.26 | NumAromaticRings: | 1 |
Unique Aglycone
AD31621
Formula: C8H8O2N3Cl
Smiles:
CCOC(=O)c1nnc(Cl)cc1N| HBA: | 5 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.29 |
| AlogP: | 0.89 | Num_rotatable_bonds: | 2 |
| MolWt: | 201.61 | Num_heavy_atoms: | 13 |
| TPSA: | 78.1 | NumAromaticRings: | 1 |
