Glycoside
GD001315
Name:
NoneFormula:
C15H18O6N2S2Smiles:
O=C(NCc1cccs1)c1csc([C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)n1Aglycone:
O=C(NCc1cccs1)c1cscn1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.47 |
| AlogP: | -0.35 | Num_rotatable_bonds: | 5 |
| MolWt: | 386.45 | Num_heavy_atoms: | 25 |
| TPSA: | 132.14 | NumAromaticRings: | 2 |
Unique Aglycone
AD01348
Formula: C9H8ON2S2
Smiles:
O=C(NCc1cccs1)c1cscn1| HBA: | 3 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.11 |
| AlogP: | 2.13 | Num_rotatable_bonds: | 3 |
| MolWt: | 224.31 | Num_heavy_atoms: | 14 |
| TPSA: | 41.99 | NumAromaticRings: | 2 |
