Basic information
- Standard SMILES
CC(=O)SCCC(S)CCCCC(N)=O- InChIKey
WXCOTNFMLYTGPZ-UHFFFAOYSA-N- Molecular formula
- C10H19NO2S2
- Average molar mass
- 249.4 g/mol
- Monoisotopic mass
- 249.0857212
Overview
S(8)-acetyldihydrolipoamide is a S-substituted dihydrolipoamide.
Names & identifiers
- Preferred name
- 8-(Acetylsulfanyl)-6-sulfanyloctanamide
- IUPAC
- S-(8-amino-8-oxo-3-sulfanyloctyl) ethanethioate
Names & synonyms
8-(acetylsulfanyl)-6-sulfanyloctanamideDTXSID701344218RefChem:1074623DTXCID501772908S-Acetyldihydrolipoamide-ES(8)-acetyldihydrolipoamideS-(8-amino-8-oxo-3-sulfanyloctyl) ethanethioate8-S-acetyldihydrolipoamideCHEBI:50623LMFA08020202Q27122153
Database identifiers
- PubChem CID
- 24906332
- DTXSID
DTXSID701344218- ChEBI
CHEBI:50623
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 86.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 9
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 210
Experimental & physicochemical properties
LipidsFatty Acyls [FA] -> Fatty amides [FA08] -> N-acyl amines [FA0802]
Physical DescriptionSolid
Chemistry & industry
Pharmacology
Metabolite PathwaysLeigh Syndrome
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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