LMFA01170109
  LIPID_MAPS_STRUCTURE_DATABASE

  9  8  0  0  0  0  0  0  0  0999 V2000
    9.1440    5.6582    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4325    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7211    5.6582    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0096    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2982    5.6582    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8553    5.2475    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.1440    6.4797    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5544    5.2475    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.3060    6.4797    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  2  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  1  6  1  0  0  0  0
  1  7  2  0  0  0  0
  8  5  1  0  0  0  0
  5  9  2  0  0  0  0
M  END
> <LM_ID>
LMFA01170109

> <COMMON_NAME>
Glutaconic acid

> <SYSTEMATIC_NAME>
2E-pentenedioic acid

> <FORMULA>
C5H6O4

> <MASS>
130.03

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty Acids and Conjugates [FA01]

> <SUB_CLASS>
Dicarboxylic acids [FA0117]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
XVOUMQNXTGKGMA-OWOJBTEDSA-N

> <INCHI>
InChI=1S/C5H6O4/c6-4(7)2-1-3-5(8)9/h1-2H,3H2,(H,6,7)(H,8,9)/b2-1+

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

> <KEGG_ID>
C02214

> <HMDB_ID>
HMDB0000620

> <CHEBI_ID>
15670

> <ABBREVIATION>
FA 5:2;O2

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5280498

> <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>
-

> <CITATION>
-

$$$$