LMFA01060241
  LIPID_MAPS_STRUCTURE_DATABASE

 30 29  0     0  0            999 V2000
   -0.4371   -0.2525    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4371   -0.7571    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4371    0.7571    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3178   -0.7571    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1989   -0.2525    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0800   -0.7571    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9610   -0.2525    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8421   -0.7571    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7232   -0.2525    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6043   -0.7571    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.4853   -0.2525    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.3664   -0.2525    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.2475   -0.7571    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.1286   -0.2525    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.0096   -0.7571    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.8907   -0.7571    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -12.7718   -0.2525    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -13.6529   -0.7571    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -14.5339   -0.2525    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -15.4150   -0.7571    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -16.2961   -0.2525    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -17.1772   -0.2525    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -18.0582   -0.7571    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -18.9393   -0.2525    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -19.8204   -0.7571    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -20.7014   -0.2525    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -21.5825   -0.7571    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -22.4636   -0.2525    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -20.7014    0.7475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -21.5825   -1.7571    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
  4  5  2  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  2  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  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
 13 14  2  0  0  0  0
 14 15  1  0  0  0  0
 15 16  2  0  0  0  0
 16 17  1  0  0  0  0
 17 18  2  0  0  0  0
 18 19  1  0  0  0  0
 19 20  2  0  0  0  0
 20 21  1  0  0  0  0
 21 22  2  0  0  0  0
 22 23  1  0  0  0  0
 23 24  2  0  0  0  0
 24 25  1  0  0  0  0
 25 26  2  0  0  0  0
 26 27  1  0  0  0  0
 27 28  1  0  0  0  0
 26 29  1  0     0  0
 27 30  2  0     0  0
M  END
> <LM_ID>
LMFA01060241

> <COMMON_NAME>
2-Dehydro-3-deoxylaetiporic acid A

> <SYSTEMATIC_NAME>
24-methyl-25-oxohexacosa-2E,5E,7E,9Z,11E,13Z,15E,17E,19Z,21E,23E-undecaenoic acid

> <FORMULA>
C27H30O3

> <MASS>
402.22

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty Acids and Conjugates [FA01]

> <SUB_CLASS>
Oxo fatty acids [FA0106]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
ZUWHINCAQDXMJU-CENJIFQDSA-N

> <INCHI>
InChI=1S/C27H30O3/c1-25(26(2)28)23-21-19-17-15-13-11-9-7-5-3-4-6-8-10-12-14-16-18-20-22-24-27(29)30/h3-19,21-24H,20H2,1-2H3,(H,29,30)/b5-3-,6-4+,9-7+,10-8-,13-11+,14-12+,17-15-,18-16+,21-19+,24-22+,25-23+

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
FA 27:12;O

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
11304202

> <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>
Branched fatty acids [FA0102]; Unsaturated fatty acids [FA0103]

> <ALT_CLASS_LEVEL4S>
-; -

> <TAXONOMY>
5630

> <CITATION>
15797608

$$$$