LMFA01090142
  LIPID_MAPS_STRUCTURE_DATABASE

  9  8  0  0  0  0  0  0  0  0999 V2000
    7.1688    6.0999    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1688    6.9527    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.6809    5.6737    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0718    5.2604    0.0000 I   0  0  0  0  0  0  0  0  0  0  0  0
    6.4248    5.6737    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1631    5.2475    0.0000 I   0  0  0  0  0  0  0  0  0  0  0  0
    7.9070    5.6737    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.6452    6.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3835    5.6737    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  7  1  1  0  0  0  0
  1  2  2  0  0  0  0
  1  5  1  0  0  0  0
  5  3  2  0  0  0  0
  3  4  1  0  0  0  0
  5  6  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
M  END
> <LM_ID>
LMFA01090142

> <COMMON_NAME>
Ethyl (Z) 2,3-diiodoacrylate

> <SYSTEMATIC_NAME>
Ethyl 2,3-diiodo-2Z-propenoate

> <FORMULA>
C5H6I2O2

> <MASS>
351.85

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty Acids and Conjugates [FA01]

> <SUB_CLASS>
Halogenated fatty acids [FA0109]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
BGWAPSOQPCDAFQ-ARJAWSKDSA-N

> <INCHI>
InChI=1S/C5H6I2O2/c1-2-9-5(8)4(7)3-6/h3H,2H2,1H3/b4-3-

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

> <KEGG_ID>
-

> <HMDB_ID>
-

> <CHEBI_ID>
-

> <ABBREVIATION>
-

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
12032279

> <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>
260499

> <CITATION>
11958814

$$$$