Glycoside
GD046483
Name:
NoneFormula:
C13H16O4N2SSmiles:
CSc1nc2ccccc2n1[C@H]1O[C@@H](CO)[C@@H](O)[C@@H]1OAglycone:
CSC1=Nc2ccccc2[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.46 |
| AlogP: | 0.37 | Num_rotatable_bonds: | 3 |
| MolWt: | 296.35 | Num_heavy_atoms: | 20 |
| TPSA: | 87.74 | NumAromaticRings: | 2 |
Unique Aglycone
AD25388
Formula: C8H7N2S
Smiles:
CSC1=Nc2ccccc2[N]1| HBA: | 2 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.12 |
| AlogP: | 2.29 | Num_rotatable_bonds: | 0 |
| MolWt: | 163.22 | Num_heavy_atoms: | 11 |
| TPSA: | 26.46 | NumAromaticRings: | 1 |
