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CHEBI:199008 - 7-(4-But-1-enyl-2,5-dioxo-2,5-dihydro-furan-3-ylmethyl)-4,5-dicarboxy-non-5-enoic acid

ChEBI IDCHEBI:199008
ChEBI Name7-(4-But-1-enyl-2,5-dioxo-2,5-dihydro-furan-3-ylmethyl)-4,5-dicarboxy-non-5-enoic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H24O9
Net Charge0
Average Mass408.403
Monoisotopic Mass408.14203
SMILESCC/C=C/C1=C(CC(/C=C(\C(=O)O)C(CCC(=O)O)C(=O)O)CC)C(=O)OC1=O
InChIInChI=1S/C20H24O9/c1-3-5-6-13-15(20(28)29-19(13)27)10-11(4-2)9-14(18(25)26)12(17(23)24)7-8-16(21)22/h5-6,9,11-12H,3-4,7-8,10H2,1-2H3,(H,21,22)(H,23,24)(H,25,26)/b6-5+,14-9-
InChIKeyIRKXZIBEKDUKQO-RLKLUXQTSA-N
ChEBI Ontology
Outgoing Relation(s)
7-(4-But-1-enyl-2,5-dioxo-2,5-dihydro-furan-3-ylmethyl)-4,5-dicarboxy-non-5-enoic acid (CHEBI:199008) has functional parent hexacarboxylic acid (CHEBI:59359)
7-(4-But-1-enyl-2,5-dioxo-2,5-dihydro-furan-3-ylmethyl)-4,5-dicarboxy-non-5-enoic acid (CHEBI:199008) is a organooxygen compound (CHEBI:36963)
IUPAC Name 
(Z)-6-[[4-[(E)-but-1-enyl]-2,5-dioxouran-3-yl]methyl]oct-4-ene-1,3,4-tricarboxylic acid
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