LMFA01020016
  LIPID_MAPS_STRUCTURE_DATABASE

 21 20  0     0  0            999 V2000
   12.9883    7.0605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7206    7.0605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8545    7.5605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.5866    7.5605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.4527    7.0605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.3188    7.5605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.1848    7.0605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.0510    7.5605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.9169    7.0605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.7830    7.5605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.6492    7.0605    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   20.7830    8.5605    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.1224    7.5605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2563    7.0605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3904    7.5605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5244    7.0605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6585    7.5605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7925    7.0605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9266    7.5605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0606    7.0605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7925    6.0606    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  3  1  0  0  0  0
  3  1  1  0  0  0  0
  4  2  1  0  0  0  0
  5  4  1  0  0  0  0
  6  5  1  0  0  0  0
  7  6  1  0  0  0  0
  8  7  1  0  0  0  0
  9  8  1  0  0  0  0
 10  9  1  0  0  0  0
 11 10  1  0  0  0  0
 10 12  2  0  0  0  0
 13  1  1  0  0  0  0
 14 13  1  0  0  0  0
 15 14  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
 18 21  1  0  0  0  0
M  END
> <LM_ID>
LMFA01020016

> <COMMON_NAME>
Anteisononadecanoic acid

> <SYSTEMATIC_NAME>
16-methyl-octadecanoic acid

> <FORMULA>
C19H38O2

> <MASS>
298.29

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty Acids and Conjugates [FA01]

> <SUB_CLASS>
Branched fatty acids [FA0102]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
16-methyl stearic acid

> <INCHI_KEY>
PCGKIWPTIJPQHI-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C19H38O2/c1-3-18(2)16-14-12-10-8-6-4-5-7-9-11-13-15-17-19(20)21/h18H,3-17H2,1-2H3,(H,20,21)

> <SMILES>
C(CCCCCC(C)CC)CCCCCCCCC(=O)O

> <KEGG_ID>
-

> <HMDB_ID>
HMDB0038070

> <CHEBI_ID>
84875

> <ABBREVIATION>
FA 19:0

> <CAYMAN_ID>
36476

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5282601

> <LIPIDBANK_ID>
DFA0241

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
93696; 27929

> <CITATION>
11942485; 16842768

$$$$