LMFA01030801
  LIPID_MAPS_STRUCTURE_DATABASE

 11 10  0  0  0  0  0  0  0  0999 V2000
    9.3050    6.4807    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0170    6.0696    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.3050    7.3029    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.5878    6.0696    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    7.8703    6.4807    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1527    6.0696    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4351    6.4807    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7176    6.0696    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    6.4807    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5878    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7176    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  2  0  0  0  0
  8  9  1  0  0  0  0
  4 10  1  0  0  0  0
  8 11  1  0  0  0  0
M  END
> <LM_ID>
LMFA01030801

> <COMMON_NAME>
2,6-Dimethyl-5-heptenoic acid

> <SYSTEMATIC_NAME>
2,6-Dimethyl-5-heptenoic acid

> <FORMULA>
C9H16O2

> <MASS>
156.12

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty Acids and Conjugates [FA01]

> <SUB_CLASS>
Unsaturated fatty acids [FA0103]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
YZGRYUUGPWDZTQ-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C9H16O2/c1-7(2)5-4-6-8(3)9(10)11/h5,8H,4,6H2,1-3H3,(H,10,11)

> <SMILES>
C(C(C)CC/C=C(\C)/C)(=O)O

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
195757

> <ABBREVIATION>
FA 9:1

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
12584678

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
Fatty Acyls [FA]

> <ALT_MAIN_CLASSES>
Fatty Acids and Conjugates [FA01]

> <ALT_SUB_CLASSES>
Branched fatty acids [FA0102]

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$