Basic information
- CAS
98441-85-1- Standard SMILES
O=C(O)CCCC[C@H](S)CCS- InChIKey
IZFHEQBZOYJLPK-ZETCQYMHSA-N- Molecular formula
- C8H16O2S2
- Average molar mass
- 208.3 g/mol
- Monoisotopic mass
- 208.0591721
Overview
(S)-dihydrolipoic acid is the (S)-enantiomer of dihydrolipoic acid. It is an enantiomer of a (R)-dihydrolipoic acid.
Names & identifiers
- Preferred name
- (S)-dihydrolipoic acid
- IUPAC
- (6S)-6,8-bis(sulfanyl)octanoic acid
- English name
- S-(-)-Dihydrolipoic Acid
- Molecular formula
- C8H16O2S2
- Molecular weight
- 208.34
Names & synonyms
(S)-dihydrolipoic acid(-)-dihydrolipoic acid(6S)-6,8-disulfanyloctanoic acidDihydrothioctic acid, (S)-N8689077SO(s)-dihydro-alpha-lipoic acid6S,8-dimercapto-octanoic acidSDHLAOctanoic acid, 6,8-dimercapto-, (S)-98441-85-1UNII-N8689077SOOctanoic acid, 6,8-dimercapto-, (6S)-
Show more names
S-DHLAS-(-)-Dihydrolipoic Acid
(S)-DHLA(6S)-DHLA(S)-6,8-dihydrothioctic acidCHEBI:30318(6S)-6,8-dihydrothioctic acid(6S)-6,8-dimercaptooctanoic acid(S)-DIHYDRO-.ALPHA.-LIPOIC ACIDRefChem:70482
Database identifiers
- CAS
98441-85-1- PubChem CID
- 449141
- ChEBI
CHEBI:30318- UNII
- N8689077SO
- Nikkaji
- J67.183E
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 39.3 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 128
Experimental & physicochemical properties
LipidsFatty Acyls [FA] -> Fatty Acids and Conjugates [FA01] -> Thia fatty acids [FA0113]
Physicochemical properties
- Boiling point
- 360.8 · 360.8±32.0 °C(Predicted)
- Density
- 1.134 · 1.134±0.06 g/cm3(Predicted)
- pka
- 4.74 · 4.74±0.10(Predicted)
- FDA UNII
- 8689077 SO · N8689077SO
Chemistry & industry
Suppliers2 total
深圳市创鑫生物科技有限公司13417589054 · [email protected]
深圳市创鑫生物科技有限公司13417589054 · [email protected]
Additional notes
DefinitionChEBI: (S)-dihydrolipoic acid is the (S)-enantiomer of dihydrolipoic acid. It is an enantiomer of a (R)-dihydrolipoic acid.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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