LMFA07040046
  LIPID_MAPS_STRUCTURE_DATABASE

 16 16  0     0  0            999 V2000
    8.6781    9.8489    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5375    9.3375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5243    8.3376    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3836    7.8262    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3706    6.8265    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4980    6.3379    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6386    6.8491    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7661    6.3605    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9067    6.8719    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9199    7.8718    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0605    8.3832    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0736    9.3832    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9461    9.8716    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9593   10.8715    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6912   10.8488    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.8055    9.3603    0.0000 O   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
  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  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  6  0  0  0
  1 15  2  0  0  0  0
  1 16  1  0  0  0  0
 13 16  1  0  0  0  0
M  END
> <LM_ID>
LMFA07040046

> <COMMON_NAME>
S-cucujolide III

> <SYSTEMATIC_NAME>
5Z-Tetradecen-13S-olide

> <FORMULA>
C14H24O2

> <MASS>
224.18

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty esters [FA07]

> <SUB_CLASS>
Lactones [FA0704]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
UNYFVMZKRMXDRF-AGLBCWCQSA-N

> <INCHI>
InChI=1S/C14H24O2/c1-13-11-9-7-5-3-2-4-6-8-10-12-14(15)16-13/h4,6,13H,2-3,5,7-12H2,1H3/b6-4-/t13-/m0/s1

> <SMILES>
C1(O[C@@H](C)CCCCCCC=CCCC1)=O

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
177102

> <ABBREVIATION>
FA 14:2

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
10867948

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
Fatty Acyls [FA]

> <ALT_MAIN_CLASSES>
Fatty Acids and Conjugates [FA01]

> <ALT_SUB_CLASSES>
Unsaturated fatty acids [FA0103]

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
1173686

> <CITATION>
24302251

$$$$