Glycoside
GD063923
Name:
NoneFormula:
C11H17O6N3S2Smiles:
Cc1nnc(SCC(=O)N[C@H]2[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)s1Aglycone:
Cc1nnc(SCC(N)=O)s1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.73 |
| AlogP: | -2.15 | Num_rotatable_bonds: | 5 |
| MolWt: | 351.41 | Num_heavy_atoms: | 22 |
| TPSA: | 145.03 | NumAromaticRings: | 1 |
Unique Aglycone
AD30752
Formula: C5H7ON3S2
Smiles:
Cc1nnc(SCC(N)=O)s1| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.4 |
| AlogP: | 0.42 | Num_rotatable_bonds: | 3 |
| MolWt: | 189.26 | Num_heavy_atoms: | 11 |
| TPSA: | 68.87 | NumAromaticRings: | 1 |
