LMFA07010962
  LIPID_MAPS_STRUCTURE_DATABASE

  9  8  0  0  0  0            999 V2000
   -1.5211   -0.5338    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6987   -0.2871    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2052   -0.9450    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6165    0.5338    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0415    0.9450    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7809    0.5338    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5211    0.9450    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7809   -0.2871    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5211   -0.5338    0.0000 C   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
  2  4  1  0  0  0  0
  4  5  2  0  0  0  0
  5  6  1  0  0  0  0
  6  7  2  0  0  0  0
  6  8  1  0  0  0  0
  8  9  1  0  0  0  0
M  END
> <LM_ID>
LMFA07010962

> <COMMON_NAME>
Methyl hydrogen fumarate

> <SYSTEMATIC_NAME>
(2Z)-4-methoxy-4-oxobut-2-enoic acid

> <FORMULA>
C5H6O4

> <MASS>
130.03

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty esters [FA07]

> <SUB_CLASS>
Short fatty esters [FA0710]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
NKHAVTQWNUWKEO-IHWYPQMZSA-N

> <INCHI>
InChI=1S/C5H6O4/c1-9-5(8)3-2-4(6)7/h2-3H,1H3,(H,6,7)/b3-2-

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

> <KEGG_ID>
-

> <HMDB_ID>
HMDB0033809

> <CHEBI_ID>
-

> <ABBREVIATION>
SFE 5:2;O2

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
5354456

> <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>
-

$$$$