Fumarprotocetraric Acid

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Catalog Number ACM489509
CAS 489-50-9
Structure {[CurrentData.Name]}
IUPAC Name 4-[[(E)-3-carboxyprop-2-enoyl]oxymethyl]-10-formyl-3,9-dihydroxy-1,7-dimethyl-6-oxobenzo[b][1,4]benzodioxepine-2-carboxylic acid
Molecular Weight 472.4
Molecular Formula C22H16O12
Canonical SMILES CC1=CC(=C(C2=C1C(=O)OC3=C(O2)C(=C(C(=C3COC(=O)C=CC(=O)O)O)C(=O)O)C)C=O)O
Inchi InChI=1S/C22H16O12/c1-8-5-12(24)10(6-23)19-15(8)22(31)34-20-11(7-32-14(27)4-3-13(25)26)17(28)16(21(29)30)9(2)18(20)33-19/h3-6,24,28H,7H2,1-2H3,(H,25,26)(H,29,30)/b4-3+
InChIKey VEGGRTFDFMUBPD-ONEGZZNKSA-N
Purity 98%
Appearance White-pale yellow powder

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