Glycoside
GD036594
Name:
NoneFormula:
C16H22O6N4SSmiles:
[N-]=[N+]=NCCCC(=O)Nc1ccc(S[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)cc1Aglycone:
[N-]=[N+]=NCCCC(=O)Nc1ccc(S)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.56 |
| AlogP: | 0.61 | Num_rotatable_bonds: | 8 |
| MolWt: | 398.44 | Num_heavy_atoms: | 27 |
| TPSA: | 168.01 | NumAromaticRings: | 1 |
Unique Aglycone
AD23070
Formula: C10H12ON4S
Smiles:
[N-]=[N+]=NCCCC(=O)Nc1ccc(S)cc1| HBA: | 5 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.3 |
| AlogP: | 3.0 | Num_rotatable_bonds: | 5 |
| MolWt: | 236.3 | Num_heavy_atoms: | 16 |
| TPSA: | 77.86 | NumAromaticRings: | 1 |
