LMPK15030053
  LIPID_MAPS_STRUCTURE_DATABASE

 26 26  0     0  0            999 V2000
  -10.9618   -3.2516    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.8297   -2.7506    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.0876   -2.7506    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.2129   -3.2516    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.3383   -2.7506    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.4636   -3.2516    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5890   -2.7506    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7144   -3.2516    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8397   -2.7506    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9651   -2.7506    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0905   -3.2516    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2158   -2.7506    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3412   -3.2516    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4665   -2.7506    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4081   -3.2516    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2827   -2.7506    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1574   -3.2516    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0320   -2.7506    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2158   -1.7484    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  -12.6957   -3.2506    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -13.5617   -2.7506    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -13.5617   -1.7506    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -12.6957   -1.2506    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.8297   -1.7506    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -14.4277   -3.2506    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  -12.6957   -0.2506    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  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
 12 19  1  1  0  0  0
  2 20  1  0     0  0
 20 21  2  0     0  0
 21 22  1  0     0  0
 22 23  2  0     0  0
 23 24  1  0     0  0
 24  2  2  0     0  0
 21 25  1  0     0  0
 23 26  1  0     0  0
M  END
> <LM_ID>
LMPK15030053

> <COMMON_NAME>


> <SYSTEMATIC_NAME>
5-(11S-hydroxy-8Z-heptadecenyl) resorcinol

> <FORMULA>
C23H38O3

> <MASS>
362.28

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Phenolic lipids [PK15]

> <SUB_CLASS>
Alkyl resorcinols and derivatives [PK1503]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
QKJHTDPOTJRZOH-DGDFFNOKSA-N

> <INCHI>
InChI=1S/C23H38O3/c1-2-3-4-12-15-21(24)16-13-10-8-6-5-7-9-11-14-20-17-22(25)19-23(26)18-20/h10,13,17-19,21,24-26H,2-9,11-12,14-16H2,1H3/b13-10-/t21-/m0/s1

> <SMILES>
C(CCCCCC/C=C\C[C@@H](O)CCCCCC)C1=CC(O)=CC(O)=C1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
23626633

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
681493

> <CITATION>
17629327

$$$$