LMFA01020111
  LIPID_MAPS_STRUCTURE_DATABASE

  7  6  0  0  0  0  0  0  0  0999 V2000
    5.0000    6.8975    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7145    6.4850    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4290    6.8975    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1435    6.4850    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.4290    7.7225    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.7145    5.6600    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0001    5.2475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  3  2  1  0  0  0  0
  4  3  1  0  0  0  0
  3  5  2  0  0  0  0
  2  6  1  0  0  0  0
  6  7  1  0  0  0  0
M  END
> <LM_ID>
LMFA01020111

> <COMMON_NAME>
2-ethyl acrylic acid

> <SYSTEMATIC_NAME>
2-ethyl-2-propenoic acid

> <FORMULA>
C5H8O2

> <MASS>
100.05

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty Acids and Conjugates [FA01]

> <SUB_CLASS>
Branched fatty acids [FA0102]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
WROUWQQRXUBECT-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C5H8O2/c1-3-4(2)5(6)7/h2-3H2,1H3,(H,6,7)

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

> <KEGG_ID>
-

> <HMDB_ID>
HMDB0001862

> <CHEBI_ID>
84978

> <ABBREVIATION>
FA 5:1

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
19166

> <LIPIDBANK_ID>
DFA7079

> <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>
-

$$$$