LMFA07040039
  LIPID_MAPS_STRUCTURE_DATABASE

 17 18  0     0  0            999 V2000
    9.4902    8.9727    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2030    9.7950    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5495   10.3709    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6975   10.5519    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8662   10.2919    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.2695    9.6574    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0606    8.8118    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2935    7.9724    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9081    7.3551    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7467    7.1189    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5919    7.3221    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7336    7.1093    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2887    8.1295    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4415    8.4737    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.6430   11.7121    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.4404    8.2799    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2325    6.0606    0.0000 C   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  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  2  0  0  0  0
 12 13  1  0  0  0  0
  1 13  2  0  0  0  0
  1 14  1  0  0  0  0
 11 14  1  0  0  0  0
  4 15  2  0  0  0  0
 13 16  1  0  0  0  0
 12 17  1  0  0  0  0
M  END
> <LM_ID>
LMFA07040039

> <COMMON_NAME>
12,13-Dimethyl-5,14-dioxabicyclo[9.2.1]-tetradeca-1(13),11-dien-4-one

> <SYSTEMATIC_NAME>
12,13-Dimethyl-5,14-dioxabicyclo[9.2.1]-tetradeca-1(13),11-dien-4-one

> <FORMULA>
C14H20O3

> <MASS>
236.14

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty esters [FA07]

> <SUB_CLASS>
Lactones [FA0704]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
WLZAQMWDLSAMIH-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C14H20O3/c1-10-11(2)13-7-8-14(15)16-9-5-3-4-6-12(10)17-13/h3-9H2,1-2H3

> <SMILES>
C12OC(=C(C)C=1C)CCCCCOC(=O)CC2

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
169442

> <ABBREVIATION>
FA 14:4;O

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
25265919

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
Fatty Acyls [FA]; Fatty Acyls [FA]; Fatty Acyls [FA]

> <ALT_MAIN_CLASSES>
Fatty Acids and Conjugates [FA01]; Fatty Acids and Conjugates [FA01]; Fatty Acids and Conjugates [FA01]

> <ALT_SUB_CLASSES>
Unsaturated fatty acids [FA0103]; Branched fatty acids [FA0102]; Carbocyclic fatty acids [FA0114]

> <ALT_CLASS_LEVEL4S>
-; -; -

> <TAXONOMY>
161252

> <CITATION>
16586036

$$$$