Glycoside
GD077196
Name:
NoneFormula:
C15H17O7NS2Smiles:
C=C(c1ccco1)[C@H]1SC(=S)N([C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)C1=OAglycone:
C=C(c1ccco1)C1SC(=S)NC1=OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.47 |
| AlogP: | -0.68 | Num_rotatable_bonds: | 4 |
| MolWt: | 387.44 | Num_heavy_atoms: | 25 |
| TPSA: | 123.6 | NumAromaticRings: | 1 |
Unique Aglycone
AD35462
Formula: C9H7O2NS2
Smiles:
C=C(c1ccco1)C1SC(=S)NC1=O| HBA: | 3 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.11 |
| AlogP: | 1.81 | Num_rotatable_bonds: | 2 |
| MolWt: | 225.29 | Num_heavy_atoms: | 14 |
| TPSA: | 42.24 | NumAromaticRings: | 1 |
