input word = C00019425

Metabolite InformationStructural formula
Name Emoroidone
(E)-7-Hydroxy-8-(3-hydroxy-3-methyl-1-butenyl)-5-methoxy-2-phenyl-4H-1-benzopyran-4-one
Formula C21H20O5
Mw 352.13107375
CAS RN 169397-85-7
C_ID C00019425 ,
InChIKey YULGQUQZFCSWBA-MDZDMXLPSA-N
InChICode InChI=1S/C21H20O5/c1-21(2,24)10-9-14-15(22)11-18(25-3)19-16(23)12-17(26-20(14)19)13-7-5-4-6-8-13/h4-12,22,24H,1-3H3/b10-9+
SMILES c1(cc(c2c(c1/C=C/C(C)(C)O)oc(cc2=O)c1ccccc1)OC)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeTephrosia emoroides Ref.
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OrganismTephrosia emoroides
ReferenceMachocho,Int. J. Pharmacognosy,33,(1995),222