LMFA01130003
  LIPID_MAPS_STRUCTURE_DATABASE

 12 11  0  0  0  0  0  0  0  0999 V2000
    8.3529    6.4850    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0672    6.0726    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9239    6.4850    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7818    6.4851    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2095    6.0726    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4962    6.0727    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4950    6.4850    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   11.9251    6.0727    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.6383    5.2475    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    7.6383    6.0726    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   11.2107    6.4851    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2107    7.3102    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1 10  1  0  0  0  0
  1  2  1  0  0  0  0
 10  3  1  0  0  0  0
  2  4  1  0  0  0  0
  3  5  1  0  0  0  0
  4  6  1  0  0  0  0
  5  7  1  0  0  0  0
  6 11  1  0  0  0  0
 11  8  1  0  0  0  0
 10  9  1  6  0  0  0
 11 12  2  0  0  0  0
M  END
> <LM_ID>
LMFA01130003

> <COMMON_NAME>
(S)-dihydrolipoic acid

> <SYSTEMATIC_NAME>
6S,8-dimercapto-octanoic acid

> <FORMULA>
C8H16O2S2

> <MASS>
208.06

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty Acids and Conjugates [FA01]

> <SUB_CLASS>
Thia fatty acids [FA0113]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
(6S)-6,8-disulfanyloctanoic acid

> <INCHI_KEY>
IZFHEQBZOYJLPK-ZETCQYMHSA-N

> <INCHI>
InChI=1S/C8H16O2S2/c9-8(10)4-2-1-3-7(12)5-6-11/h7,11-12H,1-6H2,(H,9,10)/t7-/m0/s1

> <SMILES>
C(CCCC(=O)O)[C@H](S)CCS

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
30318

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
449141

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$