Glycoside
GD009486
Name:
NoneFormula:
C12H14O5N2SSmiles:
C#CCNC(=O)c1csc([C@@H]2O[C@H](CO)[C@H](O)[C@H]2O)n1Aglycone:
C#CCNC(=O)c1cscn1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.5 |
| AlogP: | -1.34 | Num_rotatable_bonds: | 4 |
| MolWt: | 298.32 | Num_heavy_atoms: | 20 |
| TPSA: | 111.91 | NumAromaticRings: | 1 |
Unique Aglycone
AD07432
Formula: C7H6ON2S
Smiles:
C#CCNC(=O)c1cscn1| HBA: | 3 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.14 |
| AlogP: | 0.51 | Num_rotatable_bonds: | 2 |
| MolWt: | 166.2 | Num_heavy_atoms: | 11 |
| TPSA: | 41.99 | NumAromaticRings: | 1 |
