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CHEBI:166603 - Prorepensin

ChEBI IDCHEBI:166603
ChEBI NameProrepensin
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FormulaC35H44O5
Net Charge0
Average Mass544.732
Monoisotopic Mass544.31887
SMILESCC(C)=CCC/C(C)=C/Cc1cc(/C=C/C(=O)c2ccc(O)c(C/C=C(\C)CCC=C(C)C)c2O)cc(O)c1O
InChIInChI=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+
InChIKeyAMMAXRCDDGJGFY-VQHLIIBVSA-N
ChEBI Ontology
Outgoing Relation(s)
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
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