input word = C00053896

Metabolite InformationStructural formula
Name Xanthohumol M
Formula C26H30O6
Mw 438.20423869
CAS RN 1621105-61-0
C_ID C00053896
InChIKey RVJJMCFQDULSEG-UKTHLTGXSA-N
InChICode InChI=1S/C26H30O6/c1-15(2)6-12-18-23(30)22(20(28)13-9-16-7-10-17(27)11-8-16)25(31-5)19-14-21(29)26(3,4)32-24(18)19/h6-11,13,21,27,29-30H,12,14H2,1-5H3/b13-9+
SMILES COc1c2c(c(CC=C(C)C)c(O)c1C(=O)/C=C/c1ccc(O)cc1)OC(C)(C)C(O)C2
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeMedicago sativa Ref.
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