input word = C00047049

Metabolite InformationStructural formula
Name Fragnasol C
Formula C21H24O5
Mw 356.16237388
CAS RN 114892-42-1
C_ID C00047049 ,
InChIKey JRYJEMVPVZEOPW-DWKBNAGINA-N
InChICode InChI=1S/C21H24O5/c1-13-16-10-14(6-5-9-22)11-19(25-4)21(16)26-20(13)15-7-8-17(23-2)18(12-15)24-3/h5-8,10-13,20,22H,9H2,1-4H3/b6-5+/t13-,20-/m0/s1
SMILES c1c(cc2c(c1OC)O[C@@H]([C@H]2C)c1ccc(c(c1)OC)OC)/C=C/CO
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMyristicaceaeMyristica fragrans Houtt. Ref.
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