input word = C00011416

Metabolite InformationStructural formula
Name 3-Hydroxy-3,7-dimethyl-1-(2-methyl-1-propenyl)-4,6,8-nonatrienyl ester 2-methyl-2-butenoic acid
Formula C20H30O3
Mw 318.21949482
CAS RN 86948-51-8
C_ID C00011416 ,
InChIKey DVOGANCJBAEQAP-UHFFFAOYNA-N
InChICode InChI=1S/C20H30O3/c1-8-16(5)11-10-12-20(7,22)14-18(13-15(3)4)23-19(21)17(6)9-2/h8-13,18,22H,1,14H2,2-7H3/b12-10+,16-11+,17-9+/t18-,20+/m0/s1
SMILES C=CC(C)=CC=CC(C)(O)CC(C=C(C)C)OC(=O)C(C)=CC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeBejaranoa semistriata Ref.
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