LMFA01010007
  LIPID_MAPS_STRUCTURE_DATABASE

  9  8  0  0  0  0  0  0  0  0999 V2000
    5.0000    5.4125    0.0000 C   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
    6.4290    5.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1434    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8579    5.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5724    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2869    5.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0013    5.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.2869    6.2375    0.0000 O   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
  7  6  1  0  0  0  0
  8  7  1  0  0  0  0
  7  9  2  0  0  0  0
M  END
> <LM_ID>
LMFA01010007

> <COMMON_NAME>
Heptylic acid

> <SYSTEMATIC_NAME>
heptanoic acid

> <FORMULA>
C7H14O2

> <MASS>
130.10

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty Acids and Conjugates [FA01]

> <SUB_CLASS>
Straight chain fatty acids [FA0101]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
Enanthic acid; Enanthylic acid; Heptoic acid; C7:0; Enanthoic acid; Oenanthic acid

> <INCHI_KEY>
MNWFXJYAOYHMED-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C7H14O2/c1-2-3-4-5-6-7(8)9/h2-6H2,1H3,(H,8,9)

> <SMILES>
CCCCCCC(=O)O

> <KEGG_ID>
C17714

> <HMDB_ID>
HMDB0000666

> <CHEBI_ID>
45571

> <ABBREVIATION>
FA 7:0

> <CAYMAN_ID>
33672

> <SWISSLIPIDS_ID>
SLM:000389947

> <PUBCHEM_COMPOUND_ID>
8094

> <LIPIDBANK_ID>
DFA0007

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$