LMPK15010012
  LIPID_MAPS_STRUCTURE_DATABASE

 28 28  0     0  0            999 V2000
   11.9001   -5.6250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7661   -6.1250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7661   -7.1250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9001   -7.6250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0341   -7.1250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0341   -6.1250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9001   -4.6250    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.9001   -8.6251    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.1681   -5.6250    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.1681   -4.6250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0341   -9.1251    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6321   -5.6250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4982   -6.1250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3642   -5.6250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.2302   -6.1250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.0962   -5.6250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.9623   -6.1250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.8283   -5.6250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.6943   -6.1250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.5603   -5.6250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.4264   -6.1250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.2924   -5.6251    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.1584   -6.1251    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.0245   -5.6251    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.8906   -6.1251    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.7566   -5.6251    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   26.6226   -6.1251    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   27.4886   -5.6251    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0     0  0
  2  3  2  0     0  0
  3  4  1  0     0  0
  4  5  2  0     0  0
  5  6  1  0     0  0
  6  1  2  0     0  0
  1  7  1  0     0  0
  4  8  1  0     0  0
  6  9  1  0     0  0
  9 10  1  0     0  0
  8 11  1  0     0  0
  2 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  1  0     0  0
 16 17  1  0     0  0
 17 18  1  0     0  0
 18 19  1  0     0  0
 19 20  1  0     0  0
 20 21  1  0     0  0
 21 22  1  0     0  0
 22 23  1  0     0  0
 23 24  1  0     0  0
 24 25  1  0     0  0
 25 26  1  0     0  0
 26 27  1  0     0  0
 27 28  1  0     0  0
M  END
> <LM_ID>
LMPK15010012

> <COMMON_NAME>
Phaffiaol

> <SYSTEMATIC_NAME>
2,4-dimethoxy-6-heptadecylphenol

> <FORMULA>
C25H44O3

> <MASS>
392.33

> <CATEGORY>
Polyketides [PK]

> <MAIN_CLASS>
Phenolic lipids [PK15]

> <SUB_CLASS>
Alkyl phenols and derivatives [PK1501]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
PCBROMAIRGVTNX-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C25H44O3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22-20-23(27-2)21-24(28-3)25(22)26/h20-21,26H,4-19H2,1-3H3

> <SMILES>
C1(O)=C(OC)C=C(OC)C=C1CCCCCCCCCCCCCCCCC

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
9977853

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
1202

> <CITATION>
9887530

$$$$