LMFA01170009
  LIPID_MAPS_STRUCTURE_DATABASE

 16 15  0  0  0  0  0  0  0  0999 V2000
   13.8873    6.0286    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.6221    5.6041    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.8873    6.7081    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.1469    5.6041    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4063    6.0284    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6657    5.6041    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9250    6.0284    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1844    5.6041    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4438    6.0284    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7032    5.6041    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9625    6.0284    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2219    5.6041    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4813    6.0284    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7406    5.6041    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0000    6.0287    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.7406    5.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 14 16  2  0  0  0  0
M  END
> <LM_ID>
LMFA01170009

> <COMMON_NAME>
Dodecanedioic acid

> <SYSTEMATIC_NAME>
Dodecanedioic acid

> <FORMULA>
C12H22O4

> <MASS>
230.15

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty Acids and Conjugates [FA01]

> <SUB_CLASS>
Dicarboxylic acids [FA0117]

> <CLASS_LEVEL4>
-

> <SYNONYMS>


> <INCHI_KEY>
TVIDDXQYHWJXFK-UHFFFAOYSA-N

> <INCHI>
InChI=1S/C12H22O4/c13-11(14)9-7-5-3-1-2-4-6-8-10-12(15)16/h1-10H2,(H,13,14)(H,15,16)

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

> <KEGG_ID>
C02678

> <HMDB_ID>
HMDB0000623

> <CHEBI_ID>
4676

> <ABBREVIATION>
FA 12:1;O2

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
SLM:000000717

> <PUBCHEM_COMPOUND_ID>
12736

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
-

> <ALT_MAIN_CLASSES>
-

> <ALT_SUB_CLASSES>
-

> <ALT_CLASS_LEVEL4S>
-

> <TAXONOMY>
-

> <CITATION>
-

$$$$