CHEBI:192467 - Gemichalcone C

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ChEBI Name Gemichalcone C
ChEBI ID CHEBI:192467
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C30H28O9
Net Charge 0
Average Mass 532.545
Monoisotopic Mass 532.17333
InChI InChI=1S/C30H28O9/c1-18(17-39-29(36)14-5-19-4-11-26(34)28(15-19)38-2)3-9-22-25(33)13-10-23(30(22)37)24(32)12-7-20-6-8-21(31)16-27(20)35/h3-8,10-16,31,33-35,37H,9,17H2,1-2H3/b12-7+,14-5+,18-3-
InChIKey OFKHJNZDWNKYOY-DBLNWHOKSA-N
SMILES OC=1C(C/C=C(\COC(=O)\C=C\C2=CC(OC)=C(O)C=C2)/C)=C(O)C=CC1C(=O)/C=C/C3=C(O)C=C(O)C=C3
Metabolite of Species Details
Pinus radiata (NCBI:txid3347) Found in leaf (BTO:0000713). See: MetaboLights Study
ChEBI Ontology
Outgoing Gemichalcone C (CHEBI:192467) is a chalcones (CHEBI:23086)
IUPAC Name
[(Z)-4-[3-[(E)-3-(2,4-dihydroxyphenyl)prop-2-enoyl]-2,6-dihydroxyphenyl]-2-methylbut-2-enyl] (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate
Manual Xrefs Databases
8801457 ChemSpider
LMPK12120124 LIPID MAPS
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