LMFA07010505
  LIPID_MAPS_STRUCTURE_DATABASE

  7  6  0  0  0  0  0  0  0  0999 V2000
    6.5140    7.7849    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.5140    7.0909    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2080    6.5487    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2080    5.7463    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5357    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7570    6.6878    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    7.1330    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
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  2  6  1  0  0  0  0
  6  7  2  0  0  0  0
M  END
> <LM_ID>
LMFA07010505

> <COMMON_NAME>
ethyl 2E-propenoate

> <SYSTEMATIC_NAME>
ethyl 2E-propenoate

> <FORMULA>
C5H8O2

> <MASS>
100.05

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty esters [FA07]

> <SUB_CLASS>
Short fatty esters [FA0710]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
WE(2:0/3:1(2E))

> <INCHI_KEY>
JIGUQPWFLRLWPJ-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C5H8O2/c1-3-5(6)7-4-2/h3H,1,4H2,2H3

> <SMILES>
O=C(C=C)OCC

> <KEGG_ID>
C19238

> <HMDB_ID>
HMDB0033978

> <CHEBI_ID>
82327

> <ABBREVIATION>
SFE 5:1

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
8821

> <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>
-

$$$$