Glycoside
GD054515
Name:
NoneFormula:
C13H18O6N3ClSmiles:
CCOc1c(Cl)ncnc1N[C@H]1[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]1OAglycone:
CCOc1c(N)ncnc1ClSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.67 |
| AlogP: | -1.26 | Num_rotatable_bonds: | 5 |
| MolWt: | 335.74 | Num_heavy_atoms: | 22 |
| TPSA: | 137.19 | NumAromaticRings: | 1 |
Unique Aglycone
AD27776
Formula: C7H8ON3Cl
Smiles:
CCOc1c(N)ncnc1Cl| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.33 |
| AlogP: | 1.11 | Num_rotatable_bonds: | 2 |
| MolWt: | 173.6 | Num_heavy_atoms: | 11 |
| TPSA: | 61.03 | NumAromaticRings: | 1 |
