input word = C00054094

Metabolite InformationStructural formula
Name 1,7-Bis(4-hydroxyphenyl)-1-heptene-3,5-dione
Formula C21H22O4
Mw 338.15180919
CAS RN 259795-67-0
C_ID C00054094
InChIKey ZLGOKFAKQXJDSF-RWMQAMGBSA-N
InChICode InChI=1S/C21H22O4/c1-24-20-11-5-16(6-12-20)3-9-18(22)15-19(23)10-4-17-7-13-21(25-2)14-8-17/h3,5-9,11-15,22H,4,10H2,1-2H3/b9-3+,18-15-
SMILES COc1ccc(/C=C/C(O)=C/C(=O)CCc2ccc(OC)cc2)cc1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeZingiberaceaeCurcuma longa Ref.
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OrganismCurcuma longa
ReferenceAldrich Library of FT-IR Spectra, 1st edn.,1985, 2, 52C (Curcumin, ir)