input word = C00055779

Metabolite InformationStructural formula
Name cis-Verbenyl acetate
Formula C12H18O2
Mw 194.13067982
CAS RN 29135-27-1
C_ID C00055779
InChIKey VUXQSWNHFOEAOD-HRDYMLBCSA-N
InChICode InChI=1S/C11H16O3/c1-6-4-9(14-10(12)13)8-5-7(6)11(8,2)3/h4,7-9H,5H2,1-3H3,(H,12,13)/t7-,8+,9-/m1/s1
SMILES CC1=C[C@@H](OC(=O)O)[C@@H]2C[C@H]1C2(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeTanacetum macrophyllum Ref.
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