LMPR0104010022
  LIPID_MAPS_STRUCTURE_DATABASE

 21 20  0  0  0  0  0  0  0  0999 V2000
   15.7636    6.0677    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.5264    5.6271    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.7636    6.7732    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.9950    5.6271    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.2262    6.0676    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4573    5.6271    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6885    6.0676    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9196    5.6271    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1508    6.0676    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3819    5.6271    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6131    6.0676    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8442    5.6271    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0754    6.0676    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3065    5.6271    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5377    6.0676    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7688    5.6271    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    6.0676    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.9950    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9196    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8442    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7688    5.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1  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  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
  4 18  1  0  0  0  0
  8 19  1  0  0  0  0
 12 20  1  0  0  0  0
 16 21  1  0  0  0  0
M  END
> <LM_ID>
LMPR0104010022

> <COMMON_NAME>
Pristanic acid

> <SYSTEMATIC_NAME>
2,6,10,14-tetramethyl-pentadecanoic acid

> <FORMULA>
C19H38O2

> <MASS>
298.29

> <CATEGORY>
Prenol Lipids [PR]

> <MAIN_CLASS>
Isoprenoids [PR01]

> <SUB_CLASS>
C20 isoprenoids (diterpenes) [PR0104]

> <CLASS_LEVEL4>
Acyclic diterpenoids [PR010401]

> <SYNONYMS>
Pentadecanoic acid, 2,6,10,14-tetramethyl-; 2,6,10,14-Tetramethylpentadecanoic acid; Pristanic acid

> <INCHI_KEY>
PAHGJZDQXIOYTH-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C19H38O2/c1-15(2)9-6-10-16(3)11-7-12-17(4)13-8-14-18(5)19(20)21/h15-18H,6-14H2,1-5H3,(H,20,21)

> <SMILES>
C(C(C)CCCC(C)CCCC(C)CCCC(C)C)(=O)O

> <KEGG_ID>
-

> <HMDB_ID>
HMDB0000795

> <CHEBI_ID>
51340

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
123929

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$