input word = C00003154

Metabolite InformationStructural formula
Name trans-alpha-Irone
Formula C14H22O
Mw 206.16706532
CAS RN 35124-14-2
C_ID C00003154 ,
InChIKey JZQOJFLIJNRDHK-YWCKPBBJNA-N
InChICode InChI=1S/C14H22O/c1-10-6-7-11(2)14(4,5)13(10)9-8-12(3)15/h6,8-9,11,13H,7H2,1-5H3/b9-8+/t11-,13-/m0/s1
SMILES CC(=O)/C=C/[C@H]1C(C)=CC[C@H](C)C1(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeIridaceaeIris florentina Ref.
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