Glycoside
GD017526
Name:
NoneFormula:
C7H10O14N3S3Smiles:
CO[C@@H]1O[C@H](CN=[N+]=[N-])[C@H](OS(=O)(=O)[O-])[C@H](OS(=O)(=O)[O-])[C@H]1OS(=O)(=O)[O-]Aglycone:
O=S(=O)([O-])O.O=S(=O)([O-])O.O=S(=O)([O-])OSugarmoiety:
COC1OC(CN=[N+]=[N-])C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 17 | RingCount: | 1 |
| HBD: | 0 | FractionCSP3: | 1.0 |
| AlogP: | -2.8 | Num_rotatable_bonds: | 9 |
| MolWt: | 456.37 | Num_heavy_atoms: | 27 |
| TPSA: | 266.51 | NumAromaticRings: | 0 |
Unique Aglycone
AD00426
Formula: HO4S
Smiles:
O=S(=O)([O-])O| HBA: | 4 | RingCount: | 0 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | -1.0 | Num_rotatable_bonds: | 0 |
| MolWt: | 97.07 | Num_heavy_atoms: | 5 |
| TPSA: | 77.43 | NumAromaticRings: | 0 |
