LMFA01170165
  LIPID_MAPS_STRUCTURE_DATABASE

 22 22  0     0  0            999 V2000
   -8.4674   -0.2555    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.5760   -0.7663    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6843   -0.7663    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7926   -0.2555    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9009   -0.7663    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0092   -0.2555    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.3349   -0.7564    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.2025   -0.2555    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.2025    0.7463    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.3349    1.2472    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.4674    0.7463    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.5998    1.2472    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7322    0.7463    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8646    1.2472    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9971    0.7463    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1295    1.2472    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2619    0.7463    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1295    2.2490    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1449   -0.7584    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2772   -0.2613    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4128   -0.7642    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2738    0.7387    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  2  0  0  0  0
  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
  5  6  1  0  0  0  0
  1  7  1  0     0  0
  7  8  2  0     0  0
  8  9  1  0     0  0
  9 10  2  0     0  0
 10 11  1  0     0  0
 11  1  2  0     0  0
 11 12  1  0     0  0
 12 13  2  0     0  0
 13 14  1  0     0  0
 14 15  2  0     0  0
 15 16  1  0     0  0
 16 17  1  0     0  0
 16 18  2  0     0  0
  6 19  2  0     0  0
 19 20  1  0     0  0
 20 21  1  0     0  0
 20 22  2  0     0  0
M  END
> <LM_ID>
LMFA01170165

> <COMMON_NAME>


> <SYSTEMATIC_NAME>
7-[2-[4-carboxybuta-1E,3E-dienyl]phenyl]hepta-2E,4E,6Z-trienoic acid

> <FORMULA>
C18H16O4

> <MASS>
296.10

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty Acids and Conjugates [FA01]

> <SUB_CLASS>
Dicarboxylic acids [FA0117]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
OJMDEDLCJJPJFR-PZYDCVNFSA-N

> <INCHI>
InChI=1S/C18H16O4/c19-17(20)13-4-2-1-3-9-15-10-5-6-11-16(15)12-7-8-14-18(21)22/h1-14H,(H,19,20)(H,21,22)/b2-1+,9-3-,12-7+,13-4+,14-8+

> <SMILES>
C1(=C(C=C/C=C/C(=O)O)C=CC=C1)C=C/C=C/C=C/C(=O)O

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
FA 18:10;O2

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
9839140

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
Fatty Acyls [FA]; Fatty Acyls [FA]

> <ALT_MAIN_CLASSES>
Fatty Acids and Conjugates [FA01]; Fatty Acids and Conjugates [FA01]

> <ALT_SUB_CLASSES>
Unsaturated fatty acids [FA0103]; Carbocyclic fatty acids [FA0114]

> <ALT_CLASS_LEVEL4S>
-; -

> <TAXONOMY>
2593676

> <CITATION>
15387680

$$$$