LMFA01140118
  LIPID_MAPS_STRUCTURE_DATABASE

 18 18  0     0  0            999 V2000
   -5.6450   -3.2490    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5110   -3.7490    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3770   -3.2490    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3770   -2.2490    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5110   -1.7490    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6449   -2.2490    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7759   -1.7512    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9069   -2.2490    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0379   -1.7512    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1688   -2.2490    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2998   -1.7512    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4311   -3.2448    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4311   -1.7512    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4311   -2.2490    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7790   -3.7490    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7879   -3.7491    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8816   -3.3265    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0624   -3.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  6  2  0     0  0
  2  1  1  0     0  0
  3  2  2  0     0  0
  4  3  1  0     0  0
  5  4  2  0     0  0
  6  5  1  0     0  0
  7  6  1  0  0  0  0
  9  8  1  0  0  0  0
 10  9  1  0  0  0  0
 11 10  1  0  0  0  0
 14 11  1  0  0  0  0
 14 12  2  0  0  0  0
 13 14  1  0  0  0  0
  1 15  1  0     0  0
 15 16  2  0     0  0
  8  7  2  0  0  0  0
 16 17  1  0     0  0
 17 18  1  0     0  0
M  END
> <LM_ID>
LMFA01140118

> <COMMON_NAME>
Lahorenoic acid C

> <SYSTEMATIC_NAME>
6-[2-[(Z)-but-1-enyl]phenyl]hex-5E-enoic acid

> <FORMULA>
C16H20O2

> <MASS>
244.15

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty Acids and Conjugates [FA01]

> <SUB_CLASS>
Carbocyclic fatty acids [FA0114]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
IBWVVIUOUKLFMN-CPIJYIFHSA-N

> <INCHI>
InChI=1S/C16H20O2/c1-2-3-9-14-11-7-8-12-15(14)10-5-4-6-13-16(17)18/h3,5,7-12H,2,4,6,13H2,1H3,(H,17,18)/b9-3-,10-5+

> <SMILES>
C1(C=CCC)C=CC=CC=1C=CCCCC(O)=O

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
FA 16:6

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
71578967

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
Fatty Acyls [FA]

> <ALT_MAIN_CLASSES>
Fatty Acids and Conjugates [FA01]

> <ALT_SUB_CLASSES>
Unsaturated fatty acids [FA0103]

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
1415170

> <CITATION>
23402329

$$$$