LMFA01020301
  LIPID_MAPS_STRUCTURE_DATABASE

 41 40  0  0  0  0  0  0  0  0999 V2000
   24.3797    6.2903    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.0000    5.9322    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   24.3797    7.0066    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   23.7548    5.9322    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   23.1296    6.2903    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.5045    5.9322    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   21.8793    6.2903    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.2542    5.9322    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   20.6290    6.2903    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.0038    5.9322    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   19.3787    6.2903    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.7535    5.9322    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   18.1284    6.2903    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.5032    5.9322    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   16.8780    6.2903    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.2529    5.9322    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   15.6277    6.2903    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.0026    5.9322    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.3774    6.2903    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7522    5.9322    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1271    6.2903    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5019    5.9322    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8768    6.2903    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2516    5.9322    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6264    6.2903    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0013    5.9322    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3761    6.2903    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7510    5.9322    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1258    6.2903    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5006    5.9322    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8755    6.2903    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2503    5.9322    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6252    6.2903    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    5.9322    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.7548    5.2159    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.5045    5.2159    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.2542    5.2159    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.0038    5.2159    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.7535    5.2159    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.5032    5.2159    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.2529    5.2159    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  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
 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
  4 35  1  1  0  0  0
  6 36  1  1  0  0  0
  8 37  1  1  0  0  0
 10 38  1  1  0  0  0
 12 39  1  1  0  0  0
 14 40  1  1  0  0  0
 16 41  1  1  0  0  0
M  END
> <LM_ID>
LMFA01020301

> <COMMON_NAME>
Phthioceranic acid (C39)

> <SYSTEMATIC_NAME>
2S,4S,6S,8S,10S,12S,14S-heptamethyl-dotriacontanoic acid

> <FORMULA>
C39H78O2

> <MASS>
578.60

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty Acids and Conjugates [FA01]

> <SUB_CLASS>
Branched fatty acids [FA0102]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
XWYOJSCUMATACI-CXWHUAPYSA-N

> <INCHI>
InChI=1S/C39H78O2/c1-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-32(2)26-33(3)27-34(4)28-35(5)29-36(6)30-37(7)31-38(8)39(40)41/h32-38H,9-31H2,1-8H3,(H,40,41)/t32-,33-,34-,35-,36-,37-,38-/m0/s1

> <SMILES>
C([C@@H](C)C[C@@H](C)C[C@@H](C)C[C@@H](C)C[C@@H](C)C[C@@H](C)C[C@@H](C)CCCCCCCCCCCCCCCCCC)(=O)O

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
FA 39:0

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
52921733

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
1773

> <CITATION>
21285232

$$$$