Glycoside
GD023009
Name:
NoneFormula:
C12H25O4NSSmiles:
C[C@@H]1O[C@H](SCCCCCCN)[C@H](O)[C@H](O)[C@H]1OAglycone:
NCCCCCCSSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 5 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 1.0 |
| AlogP: | 0.07 | Num_rotatable_bonds: | 7 |
| MolWt: | 279.4 | Num_heavy_atoms: | 18 |
| TPSA: | 95.94 | NumAromaticRings: | 0 |
Unique Aglycone
AD00724
Formula: C6H15NS
Smiles:
NCCCCCCS| HBA: | 1 | RingCount: | 0 |
| HBD: | 2 | FractionCSP3: | 1.0 |
| AlogP: | 1.44 | Num_rotatable_bonds: | 5 |
| MolWt: | 133.26 | Num_heavy_atoms: | 8 |
| TPSA: | 26.02 | NumAromaticRings: | 0 |
