LMFA01170071
  LIPID_MAPS_STRUCTURE_DATABASE

 11 10  0  0  0  0  0  0  0  0999 V2000
    7.6976    6.4879    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6976    5.6610    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4107    6.9014    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9844    6.9014    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.9844    5.2513    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1276    6.4879    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2675    5.6610    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1238    5.6647    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.8407    6.9014    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5544    5.2475    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.2714    6.4879    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
  2  5  2  0  0  0  0
  3  6  1  0  0  0  0
  5  7  1  0  0  0  0
  6  8  1  0  0  0  0
  6  9  2  0  0  0  0
  7 10  1  0  0  0  0
  7 11  2  0  0  0  0
M  END
> <LM_ID>
LMFA01170071

> <COMMON_NAME>
3-hydroxy-cis,cis-muconic acid

> <SYSTEMATIC_NAME>
3-hydroxy-2E,4E-hexadienedioic acid

> <FORMULA>
C6H6O5

> <MASS>
158.02

> <CATEGORY>
Fatty Acyls [FA]

> <MAIN_CLASS>
Fatty Acids and Conjugates [FA01]

> <SUB_CLASS>
Dicarboxylic acids [FA0117]

> <CLASS_LEVEL4>
-

> <SYNONYMS>
3-Hydroxy-cis,cis-muconate; 3-hydroxy-cis,cis-muconate; 3-hydroxy-cis,cis-muconic acid

> <INCHI_KEY>
DLKZGMNZEDNHKO-BXTBVDPRSA-N

> <INCHI>
InChI=1S/C6H6O5/c7-4(3-6(10)11)1-2-5(8)9/h1-3,7H,(H,8,9)(H,10,11)/b2-1-,4-3+

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

> <KEGG_ID>
C03676

> <HMDB_ID>
-

> <CHEBI_ID>
17419

> <ABBREVIATION>
FA 6:3;O3

> <CAYMAN_ID>
-

> <SWISSLIPIDS_ID>
-

> <PUBCHEM_COMPOUND_ID>
54675763

> <LIPIDBANK_ID>
-

> <ALT_CATEGORIES>
Fatty Acyls [FA]; Fatty Acyls [FA]

> <ALT_MAIN_CLASSES>
Fatty Acids and Conjugates [FA01]; Fatty Acids and Conjugates [FA01]

> <ALT_SUB_CLASSES>
Unsaturated fatty acids [FA0103]; Hydroxy fatty acids [FA0105]

> <ALT_CLASS_LEVEL4S>
-; -

> <TAXONOMY>
-

> <CITATION>
-

$$$$