LMFA01050152
  LIPID_MAPS_STRUCTURE_DATABASE

 18 18  0     0  0            999 V2000
    7.9927    7.6206    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8586    7.1206    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7247    7.6206    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5908    7.1206    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4568    7.6206    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3229    7.1206    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.1889    7.6206    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9927    8.6206    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0416    8.9297    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4538    8.1206    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0416    7.3116    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7326    6.3606    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7326    9.8806    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.8586    9.1206    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7247    8.6206    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5908    9.1206    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5908   10.1206    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.4568    8.6206    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  1  0  0  0  0
  4  3  1  0  0  0  0
  5  4  1  0  0  0  0
  6  5  1  0  0  0  0
  7  6  1  0  0  0  0
  1  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  1  1  0  0  0  0
 11 12  2  0  0  0  0
  9 13  1  0  0  0  0
 14  8  1  0  0  0  0
 15 14  2  0  0  0  0
 16 15  1  0  0  0  0
 16 17  2  0  0  0  0
  5 18  2  0  0  0  0
M  END
> <LM_ID>
LMFA01050152

> <COMMON_NAME>
methyl 4-[2-(2-formyl-vinyl)-3-hydroxy-5-oxo-cyclopentyl]-butanoate

> <SYSTEMATIC_NAME>
methyl 4-[2-(2-formyl-vinyl)-3-hydroxy-5-oxo-cyclopentyl]-butanoate

> <FORMULA>
C13H18O5

> <MASS>
254.12

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty Acids and Conjugates [FA01]

> <SUB_CLASS>
Hydroxy fatty acids [FA0105]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
GMLSPPGVFGIUKF-HWKANZROSA-N

> <INCHI>
InChI=1S/C13H18O5/c1-18-13(17)6-2-4-9-10(5-3-7-14)12(16)8-11(9)15/h3,5,7,9-10,12,16H,2,4,6,8H2,1H3/b5-3+

> <SMILES>
C1(C(=O)CC(O)C1/C=C/C=O)CCCC(=O)OC

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
168669

> <ABBREVIATION>
FA 13:4;O3

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5282976

> <LIPIDBANK_ID>
DFA8095

> <ALT_CATEGORIES>
Fatty Acyls [FA]; 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]; Fatty esters [FA07]

> <ALT_SUB_CLASSES>
Unsaturated fatty acids [FA0103]; Oxo fatty acids [FA0106]; Carbocyclic fatty acids [FA0114]; Short fatty esters [FA0710]

> <ALT_CLASS_LEVEL4S>
-; -; -; -

> <TAXONOMY>
32630

> <CITATION>
-

$$$$