Glycoside
GD082305
Name:
NoneFormula:
C16H24O9N2SSmiles:
Cc1oc(S(=O)(=O)N2CCCC2)cc1C(=O)N[C@H]1[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]1OAglycone:
Cc1oc(S(=O)(=O)N2CCCC2)cc1C(N)=OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.69 |
| AlogP: | -2.1 | Num_rotatable_bonds: | 5 |
| MolWt: | 420.44 | Num_heavy_atoms: | 28 |
| TPSA: | 169.77 | NumAromaticRings: | 1 |
Unique Aglycone
AD36968
Formula: C10H14O4N2S
Smiles:
Cc1oc(S(=O)(=O)N2CCCC2)cc1C(N)=O| HBA: | 6 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.5 |
| AlogP: | 0.47 | Num_rotatable_bonds: | 3 |
| MolWt: | 258.3 | Num_heavy_atoms: | 17 |
| TPSA: | 93.61 | NumAromaticRings: | 1 |
