Glycoside
GD007262
Name:
NoneFormula:
C12H14O6N5ClSmiles:
[N-]=[N+]=NC(CCl)c1cn([C@@H]2O[C@H](CO)[C@H](O)[C@H]2O)c(=O)[nH]c1=OAglycone:
[N-]=[N+]=NC(CCl)c1c[nH]c(=O)[nH]c1=OSugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.64 |
| AlogP: | -1.26 | Num_rotatable_bonds: | 5 |
| MolWt: | 347.72 | Num_heavy_atoms: | 23 |
| TPSA: | 173.54 | NumAromaticRings: | 1 |
Unique Aglycone
AD05924
Formula: C7H6O2N5Cl
Smiles:
[N-]=[N+]=NC(CCl)c1c[nH]c(=O)[nH]c1=O| HBA: | 7 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.33 |
| AlogP: | 0.65 | Num_rotatable_bonds: | 3 |
| MolWt: | 215.6 | Num_heavy_atoms: | 14 |
| TPSA: | 114.48 | NumAromaticRings: | 1 |
