LMFA01010050
  LIPID_MAPS_STRUCTURE_DATABASE

 27 26  0  0  0  0  0  0  0  0999 V2000
    5.0000    6.9641    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    6.1322    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7203    5.7163    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4408    6.1322    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4408    6.9641    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7203    7.3799    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1611    7.3799    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8816    6.9641    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6019    7.3799    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3224    6.9641    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0428    7.3799    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7633    6.9641    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4836    7.3799    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2039    6.9641    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9244    7.3799    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6448    6.9641    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1611    5.7163    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8816    6.1322    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6019    5.7163    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3224    6.1322    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.3652    7.3799    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.0854    6.9641    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.3652    8.2117    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.0427    5.7164    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0427    5.0000    0.0000 D   0  0  0  0  0  0  0  0  0  0  0  0
   10.7054    6.0990    0.0000 D   0  0  0  0  0  0  0  0  0  0  0  0
   10.7675    5.2980    0.0000 D   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  5  6  1  0  0  0  0
  6  1  1  0  0  0  0
  7  5  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
 12 11  1  0  0  0  0
 13 12  1  0  0  0  0
 14 13  1  0  0  0  0
 15 14  1  0  0  0  0
 16 15  1  0  0  0  0
 17  4  1  0  0  0  0
 18 17  1  0  0  0  0
 19 18  1  0  0  0  0
 20 19  1  0  0  0  0
 21 16  1  0  0  0  0
 22 21  1  0  0  0  0
 21 23  2  0  0  0  0
 24 20  1  0  0  0  0
 24 25  1  0  0  0  0
 24 26  1  0  0  0  0
 24 27  1  0  0  0  0
M  END
> <LM_ID>
LMFA01010050

> <COMMON_NAME>
Behenic acid(d3)

> <SYSTEMATIC_NAME>
Docosanoic acid(d3)

> <FORMULA>
C22H41D3O2

> <MASS>
343.35

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty Acids and Conjugates [FA01]

> <SUB_CLASS>
Straight chain fatty acids [FA0101]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
UKMSUNONTOPOIO-FIBGUPNXSA-N

> <INCHI>
InChI=1S/C22H44O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(23)24/h2-21H2,1H3,(H,23,24)/i1D3

> <SMILES>
C(CCCCCCCCCCCCC(=O)O)CCCCCCCC([2H])([2H])[2H]

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
44256493

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
32630

> <CITATION>
-

$$$$