input word = C00014453

Metabolite InformationStructural formula
Name Gemichalcone A
3'-(4-Feruloyloxy-3-methylbutyl-2(Z)-enyl)-4,2',4'-trihydroxychalcone
Formula C30H28O8
Mw 516.17841787
CAS RN 189031-25-2
C_ID C00014453 ,
InChIKey OZHIKCIPCFAOPM-MZNNUVDVSA-N
InChICode InChI=1S/C30H28O8/c1-19(18-38-29(35)16-8-21-7-14-27(34)28(17-21)37-2)3-11-23-26(33)15-12-24(30(23)36)25(32)13-6-20-4-9-22(31)10-5-20/h3-10,12-17,31,33-34,36H,11,18H2,1-2H3/b13-6+,16-8+,19-3-
SMILES COc1cc(/C=C/C(=O)OC/C(C)=CCc2c(O)ccc(C(=O)/C=C/c3ccc(O)cc3)c2O)ccc1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeHypericaceaeHypericum geminiflorum Ref.
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