LMPK15040001
  LIPID_MAPS_STRUCTURE_DATABASE

 25 25  0     0  0            999 V2000
   -1.3740    0.9368    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3740   -0.1124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4654   -0.6370    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4433   -0.1124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4433    0.9368    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4654    1.4615    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4497   -1.4615    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3740    1.4615    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2458    0.9368    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1179    1.4615    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9900    0.9368    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8621    1.4615    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7341    0.9368    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6062    1.4615    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4783    0.9368    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3504    0.9368    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2225    1.4615    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0946    0.9368    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9667    0.9368    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8388    1.4615    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7109    0.9368    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5831    0.9368    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3093   -0.6124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3093   -1.6124    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1754   -0.1124    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0     0  0
  2  3  1  0     0  0
  3  4  2  0     0  0
  4  5  1  0     0  0
  5  6  2  0     0  0
  6  1  1  0     0  0
  3  7  1  0     0  0
  5  8  1  0     0  0
  8  9  1  0     0  0
  9 10  1  0     0  0
 10 11  1  0     0  0
 11 12  1  0     0  0
 12 13  1  0     0  0
 13 14  1  0     0  0
 14 15  1  0     0  0
 15 16  2  0     0  0
 16 17  1  0     0  0
 17 18  1  0     0  0
 18 19  2  0     0  0
 19 20  1  0     0  0
 20 21  1  0     0  0
 21 22  2  0     0  0
  4 23  1  0     0  0
 23 24  2  0     0  0
 23 25  1  0     0  0
M  END
> <LM_ID>
LMPK15040001

> <COMMON_NAME>
Anacardic acid

> <SYSTEMATIC_NAME>
2-hydroxy-6-[(8Z,11Z)-pentadeca-8,11,14-trienyl]benzoic acid

> <FORMULA>
C22H30O3

> <MASS>
342.22

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Phenolic lipids [PK15]

> <SUB_CLASS>
Anacardic acids and derivatives [PK1504]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
QUVGEKPNSCFQIR-UTOQUPLUSA-N

> <INCHI>
InChI=1S/C22H30O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-16-19-17-15-18-20(23)21(19)22(24)25/h2,4-5,7-8,15,17-18,23H,1,3,6,9-14,16H2,(H,24,25)/b5-4-,8-7-

> <SMILES>
C1C=C(CCCCCCC/C=C\C/C=C\CC=C)C(C(O)=O)=C(O)C=1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
183726

> <ABBREVIATION>
-

> <CAYMAN_ID>
26611

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
9875131

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
171929

> <CITATION>
-

$$$$