Glycoside
GD064679
Name:
NoneFormula:
C13H18O8N2SSmiles:
CS(=O)(=O)c1cncc(C(=O)N[C@H]2[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)c1Aglycone:
CS(=O)(=O)c1cncc(C(N)=O)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.54 |
| AlogP: | -2.99 | Num_rotatable_bonds: | 4 |
| MolWt: | 362.36 | Num_heavy_atoms: | 24 |
| TPSA: | 166.28 | NumAromaticRings: | 1 |
Unique Aglycone
AD31128
Formula: C7H8O3N2S
Smiles:
CS(=O)(=O)c1cncc(C(N)=O)c1| HBA: | 5 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.14 |
| AlogP: | -0.42 | Num_rotatable_bonds: | 2 |
| MolWt: | 200.22 | Num_heavy_atoms: | 13 |
| TPSA: | 90.12 | NumAromaticRings: | 1 |
