Glycoside
GD025020
Name:
NoneFormula:
C12H14O6N3ClSmiles:
COc1nc(Cl)c(C(N)=O)nc1[C@@H]1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
COc1cnc(C(N)=O)c(Cl)n1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.55 |
| AlogP: | -1.61 | Num_rotatable_bonds: | 4 |
| MolWt: | 319.7 | Num_heavy_atoms: | 21 |
| TPSA: | 148.02 | NumAromaticRings: | 1 |
Unique Aglycone
AD16637
Formula: C7H6O2N3Cl
Smiles:
COc1cnc(C(N)=O)c(Cl)n1| HBA: | 5 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.17 |
| AlogP: | 0.24 | Num_rotatable_bonds: | 2 |
| MolWt: | 187.59 | Num_heavy_atoms: | 12 |
| TPSA: | 78.1 | NumAromaticRings: | 1 |
