input word = C00020087

Metabolite InformationStructural formula
Name Vergosin
Formula C16H18O3
Mw 258.12559444
CAS RN 40817-06-9
C_ID C00020087 ,
InChIKey ZMCDJIAUWJBTEN-UHFFFAOYSA-N
InChICode InChI=1S/C16H18O3/c1-8(2)13-10-5-9(3)6-12-14(10)11(7-19-12)15(17)16(13)18-4/h5-6,8,17H,7H2,1-4H3
SMILES c1(c(c2COc3cc(cc(c1C(C)C)c23)C)O)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMalvaceaeGossypium barbadense Ref.
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