CHEBI:166603 - Prorepensin

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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 Prorepensin
ChEBI ID CHEBI:166603
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C35H44O5
Net Charge 0
Average Mass 544.732
Monoisotopic Mass 544.31887
InChI InChI=1S/C35H44O5/c1-23(2)9-7-11-25(5)13-16-28-21-27(22-33(38)34(28)39)15-19-31(36)30-18-20-32(37)29(35(30)40)17-14-26(6)12-8-10-24(3)4/h9-10,13-15,18-22,37-40H,7-8,11-12,16-17H2,1-6H3/b19-15+,25-13+,26-14+
InChIKey AMMAXRCDDGJGFY-VQHLIIBVSA-N
SMILES OC=1C(C\C=C(\CCC=C(C)C)/C)=C(O)C=CC1C(=O)\C=C\C2=CC(C\C=C(\CCC=C(C)C)/C)=C(O)C(O)=C2
ChEBI Ontology
Outgoing Prorepensin (CHEBI:166603) is a chalcones (CHEBI:23086)
IUPAC Name
(E)-1-[3-[(2E)-3,7-dimethylocta-2,6-dienyl]-2,4-dihydroxyphenyl]-3-[3-[(2E)-3,7-dimethylocta-2,6-dienyl]-4,5-dihydroxyphenyl]prop-2-en-1-one
Manual Xrefs Databases
552499 ChemSpider
LMPK12120107 LIPID MAPS
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