LMPK15030079
  LIPID_MAPS_STRUCTURE_DATABASE

 39 39  0  0  0  0  0  0  0  0999 V2000
   -0.4071   -5.5399    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4071   -6.5452    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4635   -7.0479    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3342   -6.5452    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3342   -5.5399    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4635   -5.0372    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4785   -7.8378    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2259   -5.0372    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1431   -5.0875    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.1028   -5.5399    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9802   -5.0372    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8575   -5.5399    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7348   -5.0372    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6122   -5.5399    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4895   -5.0372    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3668   -5.5399    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2442   -5.0372    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1215   -5.5399    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9988   -5.0372    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8762   -5.5399    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7535   -5.0372    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6309   -5.5399    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5082   -5.0372    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3855   -5.5399    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.2629   -5.0372    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.1402   -5.5399    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.0175   -5.0372    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.8949   -5.5399    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.7722   -5.0372    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.6495   -5.5399    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.5269   -5.0372    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.4042   -5.5399    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.2815   -5.0372    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.1589   -5.5399    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.0362   -5.0372    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.9006   -5.5400    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   26.7682   -5.0428    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   27.6326   -5.5456    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   28.5003   -5.0484    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  3  7  1  0  0  0  0
  5  8  1  0  0  0  0
  1  9  1  0  0  0  0
  8 10  1  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
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 26  1  0  0  0  0
 26 27  1  0  0  0  0
 27 28  1  0  0  0  0
 28 29  1  0  0  0  0
 29 30  1  0  0  0  0
 30 31  1  0  0  0  0
 31 32  1  0  0  0  0
 32 33  1  0  0  0  0
 33 34  1  0  0  0  0
 34 35  1  0  0  0  0
 35 36  1  0     0  0
 36 37  1  0     0  0
 37 38  1  0     0  0
 38 39  1  0     0  0
M  END
> <LM_ID>
LMPK15030079

> <COMMON_NAME>
5-hentriacontylresorcinol

> <SYSTEMATIC_NAME>
5-hentriacontylbenzene-1,3-diol

> <FORMULA>
C37H68O2

> <MASS>
544.52

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Phenolic lipids [PK15]

> <SUB_CLASS>
Alkyl resorcinols and derivatives [PK1503]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
MKVWJIZMTUBETH-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C37H68O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-35-32-36(38)34-37(39)33-35/h32-34,38-39H,2-31H2,1H3

> <SMILES>
C1(O)C=C(CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC)C=C(O)C=1

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
178336359

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
2768810

> <CITATION>
40733236

$$$$