LMFA01031204
  LIPID_MAPS_STRUCTURE_DATABASE

 20 19  0     0  0            999 V2000
   -0.4308   -0.2488    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4308   -0.7461    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4308    0.7461    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2987   -0.7461    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1669   -0.2488    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0352   -0.7461    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9035   -0.2488    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7717    0.2487    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6400    0.7461    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5083    1.2436    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3766    1.7410    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.2448    1.2437    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.1131    1.7410    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.9814    1.2437    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.8496    1.7410    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.7179    1.2437    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -12.5862    1.7410    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -13.4545    1.2437    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -14.3227    1.7410    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -15.1910    1.2437    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  3  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  2  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  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
M  END
> <LM_ID>
LMFA01031204

> <COMMON_NAME>
Heterofibrin A1

> <SYSTEMATIC_NAME>
9E-octadecen-5,7-diynoic acid

> <FORMULA>
C18H26O2

> <MASS>
274.19

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty Acids and Conjugates [FA01]

> <SUB_CLASS>
Unsaturated fatty acids [FA0103]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
HNHFXIBUWYZZML-MDZDMXLPSA-N

> <INCHI>
InChI=1S/C18H26O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h9-10H,2-8,15-17H2,1H3,(H,19,20)/b10-9+

> <SMILES>
C(CCCC#CC#C/C=C/CCCCCCCC)(=O)O

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
FA 18:5

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
46862734

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
2619710

> <CITATION>
20626092

$$$$