CHEBI:175914 - 8-8'-Dehydrodiferulic acid

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name 8-8'-Dehydrodiferulic acid
ChEBI ID CHEBI:175914
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C20H18O8
Net Charge 0
Average Mass 386.356
Monoisotopic Mass 386.10017
InChI InChI=1S/C20H18O8/c1-27-17-9-11(3-5-15(17)21)7-13(19(23)24)14(20(25)26)8-12-4-6-16(22)18(10-12)28-2/h3-10,21-22H,1-2H3,(H,23,24)(H,25,26)/b13-7-,14-8+
InChIKey SPKZMOSDXTYXLK-MFUUIURDSA-N
SMILES O(C=1C=C(\C=C(\C(=C/C2=CC(OC)=C(O)C=C2)\C(O)=O)/C(O)=O)C=CC1O)C
ChEBI Ontology
Outgoing 8-8'-Dehydrodiferulic acid (CHEBI:175914) is a phenylpropanoid (CHEBI:26004)
IUPAC Name
(2Z,3E)-2,3-bis[(4-hydroxy-3-methoxyphenyl)methylidene]butanedioic acid
Manual Xrefs Databases
29336462 ChemSpider
HMDB0029277 HMDB
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