input word = C00017007

Metabolite InformationStructural formula
Name (+)-Isopetasol
Isopetasol
3alpha-Hydroxy-eremophila-7(11),9-dien-8-one
Formula C15H22O2
Mw 234.16197995
CAS RN 469-67-0
C_ID C00017007 ,
InChIKey TVDMUSYVWJLIDK-SJBIYWEDNA-N
InChICode InChI=1S/C15H22O2/c1-9(2)12-8-15(4)10(3)13(16)6-5-11(15)7-14(12)17/h7,10,13,16H,5-6,8H2,1-4H3/t10-,13+,15+/m0/s1
SMILES CC(C)=C1C[C@@]2(C)C(=CC1=O)CC[C@@H](O)[C@@H]2C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaePetasites fragrans Ref.
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