LMFA01050620
  LIPID_MAPS_STRUCTURE_DATABASE

 18 17  0  0  0  0  0  0  0  0999 V2000
   15.0804   -5.0896    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.9421   -5.5871    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.0804   -4.0946    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.2124   -5.5871    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3439   -5.0896    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4755   -5.5871    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6071   -5.0896    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7387   -5.5871    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8703   -5.0896    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0019   -4.5921    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1335   -4.0946    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2651   -3.5971    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3966   -3.0995    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5282   -3.5969    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6598   -3.0995    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7914   -3.5969    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9271   -3.0940    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7880   -4.5969    0.0000 O   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
  9 10  3  0  0  0  0
 10 11  1  0  0  0  0
 11 12  3  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  1  0     0  0
 16 18  2  0     0  0
M  END
> <LM_ID>
LMFA01050620

> <COMMON_NAME>
Maoleiferacid B

> <SYSTEMATIC_NAME>
5E-tetradecene-7Y,9Y-diyn-dioic acid

> <FORMULA>
C14H16O4

> <MASS>
248.10

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty Acids and Conjugates [FA01]

> <SUB_CLASS>
Hydroxy fatty acids [FA0105]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
NANXSTLXJGEPGI-HWKANZROSA-N

> <INCHI>
InChI=1S/C14H16O4/c15-13(16)11-9-7-5-3-1-2-4-6-8-10-12-14(17)18/h3,5H,7-12H2,(H,15,16)(H,17,18)/b5-3+

> <SMILES>
C(CCC/C=C/C#CC#CCCCC(=O)O)(=O)O

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
FA 14:6;O2

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
-

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
Fatty Acyls [FA]

> <ALT_MAIN_CLASSES>
Fatty Acids and Conjugates [FA01]

> <ALT_SUB_CLASSES>
Dicarboxylic acids [FA0117]

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
397392

> <CITATION>
41871788

$$$$