Glycoside
GD006275
Name:
NoneFormula:
C17H19O4N3S2Smiles:
Cc1nsc2c1nc(SCc1ccccc1)n2[C@@H]1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
Cc1nsc2c1N=C(SCc1ccccc1)[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.41 |
| AlogP: | 1.71 | Num_rotatable_bonds: | 5 |
| MolWt: | 393.49 | Num_heavy_atoms: | 26 |
| TPSA: | 100.63 | NumAromaticRings: | 3 |
Unique Aglycone
AD05206
Formula: C12H10N3S2
Smiles:
Cc1nsc2c1N=C(SCc1ccccc1)[N]2| HBA: | 3 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.17 |
| AlogP: | 3.62 | Num_rotatable_bonds: | 2 |
| MolWt: | 260.37 | Num_heavy_atoms: | 17 |
| TPSA: | 39.35 | NumAromaticRings: | 2 |
