Glycoside
GD023251
Name:
NoneFormula:
C19H18O7N5ClSmiles:
Nc1nc(O)c2c(n1)n(C1OC(CO)[C@H](O)[C@H]1O)c(=O)n2CC(=O)c1ccc(Cl)cc1Aglycone:
Nc1nc(O)c2c(n1)[nH]c(=O)n2CC(=O)c1ccc(Cl)cc1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.33 |
| AlogP: | -0.97 | Num_rotatable_bonds: | 5 |
| MolWt: | 451.82 | Num_heavy_atoms: | 31 |
| TPSA: | 185.95 | NumAromaticRings: | 3 |
Unique Aglycone
AD15660
Formula: C14H10O3N5Cl
Smiles:
Nc1nc(O)c2c(n1)[nH]c(=O)n2CC(=O)c1ccc(Cl)cc1| HBA: | 8 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.08 |
| AlogP: | 0.94 | Num_rotatable_bonds: | 3 |
| MolWt: | 319.71 | Num_heavy_atoms: | 22 |
| TPSA: | 126.89 | NumAromaticRings: | 3 |
