Glycoside
GD018268
Name:
NoneFormula:
C7H13O14N3S3Smiles:
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)OAglycone:
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: | 3 | FractionCSP3: | 1.0 |
| AlogP: | -1.77 | Num_rotatable_bonds: | 9 |
| MolWt: | 459.39 | Num_heavy_atoms: | 27 |
| TPSA: | 258.02 | NumAromaticRings: | 0 |
Unique Aglycone
AD00034
Formula: H2O4S
Smiles:
O=S(=O)(O)O| HBA: | 4 | RingCount: | 0 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | -0.65 | Num_rotatable_bonds: | 0 |
| MolWt: | 98.08 | Num_heavy_atoms: | 5 |
| TPSA: | 74.6 | NumAromaticRings: | 0 |
