Mrv0541 07021411002D          

 18 18  0  0  0  0            999 V2000
    5.8641    0.2990    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8641   -0.5260    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1496    0.7115    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1496   -0.9385    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4351    0.2990    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4351   -0.5260    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5786    0.7115    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7207    0.7115    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7207   -0.9385    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5786   -0.9385    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2931    0.2990    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.5786   -1.7635    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2931   -0.5260    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.5786    1.5365    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7207    1.5365    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0062    0.2990    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0062   -0.5260    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7206   -1.7635    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  2  0  0  0  0
  4  2  2  0  0  0  0
  5  3  1  0  0  0  0
  6  4  1  0  0  0  0
  6  5  2  0  0  0  0
  1  7  1  0  0  0  0
  5  8  1  0  0  0  0
  6  9  1  0  0  0  0
  2 10  1  0  0  0  0
  7 11  1  0  0  0  0
 10 12  2  0  0  0  0
 10 13  1  0  0  0  0
  7 14  2  0  0  0  0
  8 15  2  0  0  0  0
  8 16  1  0  0  0  0
  9 17  1  0  0  0  0
  9 18  2  0  0  0  0
M  END
> <ID>
CHEBI:45165

> <NAME>
pyromellitic acid

> <DEFINITION>
A tetracarboxylic acid that is benzene substituted by four carboxy groups at positions 1, 2, 4 and 5 respectively.

> <STAR>
3

> <IUPAC_NAME>
benzene-1,2,4,5-tetracarboxylic acid

> <FORMULA>
C10H6O8

> <MASS>
254.14980

> <MONOISOTOPIC_MASS>
254.00627

> <CHARGE>
0

> <SMILES>
OC(=O)c1cc(C(O)=O)c(cc1C(O)=O)C(O)=O

> <INCHI>
InChI=1S/C10H6O8/c11-7(12)3-1-4(8(13)14)6(10(17)18)2-5(3)9(15)16/h1-2H,(H,11,12)(H,13,14)(H,15,16)(H,17,18)

> <INCHIKEY>
CYIDZMCFTVVTJO-UHFFFAOYSA-N

> <CAS_REGISTRY_NUMBER>
89-05-4

> <REAXYS_REGISTRY_NUMBER>
1887659

> <CHEMIDPLUS>
89-05-4

> <PDBECHEM_ACCESSION>
PMA

> <PUBMED_CITATION>
20943431; 22047800; 24734612

$$$$