LMFA01080033
  LIPID_MAPS_STRUCTURE_DATABASE

 16 15  0     0  0            999 V2000
    3.7731   -5.0750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6391   -4.5750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5051   -5.0750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3712   -4.5750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2372   -5.0750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1032   -4.5750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9692   -5.0750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8353   -4.5750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7013   -5.0750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5673   -4.5750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5673   -3.5750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.4333   -5.0750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.3712   -3.5750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2372   -3.0750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9071   -4.5750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0410   -5.0750    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
  3  4  1  0     0  0
  4  5  1  0     0  0
  5  6  1  0     0  0
  6  7  2  0     0  0
  7  8  1  0     0  0
  8  9  1  0     0  0
  9 10  1  0     0  0
 10 11  2  0     0  0
 10 12  1  0     0  0
  4 13  1  6     0  0
 13 14  1  0     0  0
  1 15  1  0     0  0
 15 16  1  0     0  0
M  END
> <LM_ID>
LMFA01080033

> <COMMON_NAME>
7(S)-methoxy-dodedec-4E-enoic acid

> <SYSTEMATIC_NAME>
7(S)-methoxy-dodedec-4E-enoic acid

> <FORMULA>
C13H24O3

> <MASS>
228.17

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty Acids and Conjugates [FA01]

> <SUB_CLASS>
Methoxy fatty acids [FA0108]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
KBMNVOKQUUZFOO-PZBABLGHSA-N

> <INCHI>
InChI=1S/C13H24O3/c1-3-4-6-9-12(16-2)10-7-5-8-11-13(14)15/h5,7,12H,3-4,6,8-11H2,1-2H3,(H,14,15)/b7-5+/t12-/m0/s1

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
FA 13:1;O

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
6479924

> <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>
158786

> <CITATION>
12169299

$$$$