input word = C00016979

Metabolite InformationStructural formula
Name Isovalencenic acid
Formula C15H22O2
Mw 234.16197995
CAS RN 22387-68-4
C_ID C00016979 ,
InChIKey VNECIGJTOXTUTM-YRVBESIJNA-N
InChICode InChI=1S/C15H22O2/c1-10-5-4-6-13-8-7-12(9-15(10,13)3)11(2)14(16)17/h6,10H,4-5,7-9H2,1-3H3,(H,16,17)/b12-11+/t10-,15+/m1/s1
SMILES C1CC=C2[C@]([C@@H]1C)(C/C(=C(/C(=O)O)\C)/CC2)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePoaceaeVetiveria sp. Ref.
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