LMFA01020413
  LIPID_MAPS_STRUCTURE_DATABASE

 16 15  0     0  0            999 V2000
   -0.4312   -0.2490    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4312   -0.7468    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4312    0.7468    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2999   -0.7468    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1690   -0.2490    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0381   -0.7468    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9072   -0.2490    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7762   -0.7468    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6453   -0.2490    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5144   -0.7468    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3835   -0.2490    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.2526   -0.7468    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.1217   -0.2490    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.9908   -0.7468    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0381   -1.7426    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.1217    0.7468    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0     0  0
  1  3  2  0     0  0
  1  4  1  0     0  0
  4  5  2  0     0  0
  5  6  1  0     0  0
  6  7  2  0     0  0
  7  8  1  0     0  0
  8  9  2  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
 13 14  1  0     0  0
  6 15  1  0     0  0
 13 16  1  0     0  0
M  END
> <LM_ID>
LMFA01020413

> <COMMON_NAME>
11-hydroxy-4-methyl-2E,4E,6E-dodecatrienoic acid

> <SYSTEMATIC_NAME>
11-hydroxy-4-methyl-2E,4E,6E-dodecatrienoic acid

> <FORMULA>
C13H20O3

> <MASS>
224.14

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty Acids and Conjugates [FA01]

> <SUB_CLASS>
Branched fatty acids [FA0102]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
4-methyl-11-hydroxy-2E,4E,6E-dodecatrienoic acid

> <INCHI_KEY>
XUQIFDLHGYJREE-HLTZDAHQSA-N

> <INCHI>
InChI=1S/C13H20O3/c1-11(9-10-13(15)16)7-5-3-4-6-8-12(2)14/h3,5,7,9-10,12,14H,4,6,8H2,1-2H3,(H,15,16)/b5-3+,10-9+,11-7+

> <SMILES>
C(/C=C/C(/C)=C/C=C/CCCC(O)C)(=O)O

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
177969

> <ABBREVIATION>
FA 13:3;O

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
10443614

> <LIPIDBANK_ID>
-

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

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

> <ALT_SUB_CLASSES>
Unsaturated fatty acids [FA0103]; Hydroxy fatty acids [FA0105]

> <ALT_CLASS_LEVEL4S>
-; -

> <TAXONOMY>
1715236

> <CITATION>
-

$$$$