LMFA01020076
  LIPID_MAPS_STRUCTURE_DATABASE

  8  7  0  0  0  0  0  0  0  0999 V2000
    5.0000    6.2374    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7145    5.8249    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4290    6.2374    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1435    5.8249    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8579    6.2374    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5725    5.8249    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.8579    7.0624    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.7145    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  1  0  0  0  0
  4  3  1  0  0  0  0
  5  4  1  0  0  0  0
  6  5  1  0  0  0  0
  5  7  2  0  0  0  0
  2  8  1  0  0  0  0
M  END
> <LM_ID>
LMFA01020076

> <COMMON_NAME>
Isocaproic acid

> <SYSTEMATIC_NAME>
4-methyl-pentanoic acid

> <FORMULA>
C6H12O2

> <MASS>
116.08

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty Acids and Conjugates [FA01]

> <SUB_CLASS>
Branched fatty acids [FA0102]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
Isohexanoic acid

> <KEGG_ID>
-

> <HMDB_ID>
HMDB0000689

> <YMDB_ID>
-

> <CHEBI_ID>
74903

> <CAYMAN_ID>
-

> <PLANTFA_ID>
10198

> <SWISSLIPIDS_ID>
-

> <ALT_CLASSES>
-

> <METABOLOMICS_ID>
-

> <PUBCHEM_COMPOUND_ID>
12587

> <LIPIDBANK_ID>
DFA7044

> <LIPIDAT_ID>
-

> <STATUS>
Active

> <REFS>
-

> <LIPID_MAPS_URL>
https://lipidmaps.org/databases/lmsd/LMFA01020076

$$$$