LMFA07100020
  LIPID_MAPS_STRUCTURE_DATABASE

 22 21  0     0  0            999 V2000
   -0.4308   -0.2488    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4308   -0.7462    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2989   -0.7462    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1673   -0.2488    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0357   -0.7462    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9041   -0.2488    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7725   -0.7462    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6409   -0.2488    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5094   -0.7462    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3778   -1.2438    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.2462   -1.7413    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.1146   -2.2388    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.9830   -2.7363    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.8514   -2.2389    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.7198   -2.7363    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2968   -0.2462    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1629   -0.7461    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2968    0.7538    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7725   -1.7462    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6386   -2.2462    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6386   -3.2462    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5046   -1.7462    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  1  3  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  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  3  0  0  0  0
 10 11  1  0  0  0  0
 11 12  3  0  0  0  0
 12 13  1  0  0  0  0
 13 14  2  0  0  0  0
 14 15  1  0  0  0  0
  2 16  1  0     0  0
 16 17  1  0     0  0
 16 18  2  0     0  0
  7 19  1  6     0  0
 19 20  1  0     0  0
 20 21  1  0     0  0
 20 22  2  0     0  0
M  END
> <LM_ID>
LMFA07100020

> <COMMON_NAME>


> <SYSTEMATIC_NAME>
Tetradeca-4E,12E-dien-8,10-diyne-1,6R-diyldiacetate

> <FORMULA>
C18H22O4

> <MASS>
302.15

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty esters [FA07]

> <SUB_CLASS>
Short fatty esters [FA0710]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
BHKYDHOSWMHYEH-UBPIRVAMSA-N

> <INCHI>
InChI=1S/C18H22O4/c1-4-5-6-7-8-10-13-18(22-17(3)20)14-11-9-12-15-21-16(2)19/h4-5,11,14,18H,9,12-13,15H2,1-3H3/b5-4+,14-11+/t18-/m1/s1

> <SMILES>
C(CC/C=C/[C@H](OC(=O)C)CC#CC#C/C=C/C)OC(=O)C

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
-

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
454324

> <CITATION>
40577108

$$$$