LMFA07090141
  LIPID_MAPS_STRUCTURE_DATABASE

 28 27  0     0  0            999 V2000
   -5.2276   -0.7090    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1789   -0.1639    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.1302   -0.7090    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1789    0.6118    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -7.1099    1.1493    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.1099    2.2242    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -7.9698    0.6118    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.8298    1.1493    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.6897    0.6118    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.5497    1.1493    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.4097    0.6118    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -12.2697    1.1493    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -13.1297    0.6118    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3676   -0.1639    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3676    0.5817    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6151   -0.7094    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -7.9903   -0.1639    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.8503   -0.7090    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.7102   -0.1639    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.5701   -0.7090    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.4580   -0.2442    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -12.3043   -0.7806    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -13.1921   -0.3158    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -14.0385   -0.8523    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -14.0146    1.0821    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -14.8643    0.5510    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -15.7492    1.0215    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -16.5989    0.4904    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0     0  0
  2  3  1  0     0  0
  2  4  1  0     0  0
  4  5  1  0     0  0
  5  6  2  0     0  0
  5  7  1  0     0  0
  7  8  1  0     0  0
  8  9  1  0     0  0
  9 10  1  0     0  0
 10 11  1  0     0  0
 11 12  1  0     0  0
 12 13  1  0     0  0
  1 14  1  0     0  0
 14 15  2  0     0  0
 14 16  1  0     0  0
  3 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
 13 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>
LMFA07090141

> <COMMON_NAME>
FAHFA 12:0/3O(FA 12:0)

> <SYSTEMATIC_NAME>
3-dodecanoyloxy-dodecanoic acid

> <FORMULA>
C24H46O4

> <MASS>
398.34

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty esters [FA07]

> <SUB_CLASS>
Fatty acid estolides [FA0709]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
BABYYHJKPYTSCW-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C24H46O4/c1-3-5-7-9-11-12-14-16-18-20-24(27)28-22(21-23(25)26)19-17-15-13-10-8-6-4-2/h22H,3-21H2,1-2H3,(H,25,26)

> <SMILES>
C(C(O)=O)C(OC(CCCCCCCCCCC)=O)CCCCCCCCC

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
FAHFA 24:0;O

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
191143

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
287

> <CITATION>
32627084

$$$$