LMPK15030061
  LIPID_MAPS_STRUCTURE_DATABASE

 25 25  0     0  0            999 V2000
  -13.6628   -0.2525    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -14.5372   -0.7573    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -12.7819   -0.7573    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.9006   -0.2525    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.0193   -0.7573    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.1380   -0.2525    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.2568   -0.7573    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.3755   -0.2525    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.4942   -0.7573    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6130   -0.7573    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7317   -0.2525    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8504   -0.7573    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9691   -0.7573    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0879   -0.2525    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2066   -0.7573    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3253   -0.2525    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4441   -0.7573    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4372   -0.2525    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -14.5372   -1.7573    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -15.4032   -2.2573    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -16.2693   -1.7573    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -16.2692   -0.7573    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -15.4032   -0.2573    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -17.1353   -0.2573    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  -15.4032   -3.2573    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  1  3  1  0  0  0  0
  3  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  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  2  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  2  0  0  0  0
  2 19  1  0     0  0
 19 20  2  0     0  0
 20 21  1  0     0  0
 21 22  2  0     0  0
 22 23  1  0     0  0
 23  2  2  0     0  0
 22 24  1  0     0  0
 20 25  1  0     0  0
M  END
> <LM_ID>
LMPK15030061

> <COMMON_NAME>
5-(heptadeca-8Z,11Z,16-trien-1-yl)resorcinol

> <SYSTEMATIC_NAME>
5-(heptadeca-8Z,11Z,16-trien-1-yl)benzene-1,3-diol

> <FORMULA>
C23H34O2

> <MASS>
342.26

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Phenolic lipids [PK15]

> <SUB_CLASS>
Alkyl resorcinols and derivatives [PK1503]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
5-heptadeca-8'Z,11'Z,16-trienylresorcinol

> <INCHI_KEY>
MFQASGNLRRKBQG-HZJYTTRNSA-N

> <INCHI>
InChI=1S/C23H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21-18-22(24)20-23(25)19-21/h2,6-7,9-10,18-20,24-25H,1,3-5,8,11-17H2/b7-6-,10-9-

> <SMILES>
C(CCCCCC/C=C\C/C=C\CCCC=C)C1=CC(O)=CC(O)=C1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
11573713

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
1045806

> <CITATION>
16643059

$$$$