Glycoside
GD067139
Name:
NoneFormula:
C13H20O8N4Smiles:
COc1nc(N[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)c(/C=N/O)c(=O)n1CAglycone:
COc1nc(N)c(C=NO)c(=O)n1CSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.62 |
| AlogP: | -3.19 | Num_rotatable_bonds: | 5 |
| MolWt: | 360.32 | Num_heavy_atoms: | 25 |
| TPSA: | 178.89 | NumAromaticRings: | 1 |
Unique Aglycone
AD32082
Formula: C7H10O3N4
Smiles:
COc1nc(N)c(C=NO)c(=O)n1C| HBA: | 7 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.29 |
| AlogP: | -0.82 | Num_rotatable_bonds: | 2 |
| MolWt: | 198.18 | Num_heavy_atoms: | 14 |
| TPSA: | 102.73 | NumAromaticRings: | 1 |
