LMFA01170065
  LIPID_MAPS_STRUCTURE_DATABASE

 13 12  0  0  0  0  0  0  0  0999 V2000
    5.0000    6.4850    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    7.3100    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7145    7.7225    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4290    7.3100    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.7145    6.0725    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4290    6.4850    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7145    8.5475    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.8578    6.5025    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5773    6.0988    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.8477    7.3275    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.7145    5.2475    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.1484    6.0813    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1586    5.2564    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  7  3  2  0  0  0  0
  4  3  1  0  0  0  0
  5  1  1  0  0  0  0
  5 11  2  0  0  0  0
  5  6  1  0  0  0  0
  6 12  1  0  0  0  0
 12  8  1  0  0  0  0
  8  9  1  0  0  0  0
  8 10  2  0  0  0  0
 12 13  2  0  0  0  0
M  END
> <LM_ID>
LMFA01170065

> <COMMON_NAME>
3-maleylpyruvic acid

> <SYSTEMATIC_NAME>
4,6-dioxo-2Z-heptenedioic acid

> <FORMULA>
C7H6O6

> <MASS>
186.02

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty Acids and Conjugates [FA01]

> <SUB_CLASS>
Dicarboxylic acids [FA0117]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
Maleylpyruvate; Maleylpyruvic acid

> <INCHI_KEY>
AZCFLHZUFANAOR-UPHRSURJSA-N

> <INCHI>
InChI=1S/C7H6O6/c8-4(1-2-6(10)11)3-5(9)7(12)13/h1-2H,3H2,(H,10,11)(H,12,13)/b2-1-

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

> <KEGG_ID>
C02167

> <HMDB_ID>
-

> <CHEBI_ID>
30859

> <ABBREVIATION>
FA 7:4;O4

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5280494

> <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]; Oxo fatty acids [FA0106]

> <ALT_CLASS_LEVEL4S>
-; -

> <TAXONOMY>
-

> <CITATION>
-

$$$$