input word = C00003199

Metabolite InformationStructural formula
Name beta-Vetivone
Formula C15H22O
Mw 218.16706532
CAS RN 18444-79-6
C_ID C00003199 ,
InChIKey ISLOGSAEQNKPGG-OPNJQGHXNA-N
InChICode InChI=1S/C15H22O/c1-10(2)13-5-6-15(9-13)11(3)7-14(16)8-12(15)4/h7,12H,5-6,8-9H2,1-4H3/t12-,15+/m1/s1
SMILES C1(=O)C[C@H]([C@]2(C(=C1)C)CC(=C(C)C)CC2)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePoaceaeVetiveria zizanioides Ref.
PlantaeSolanaceaeMandragora autumnalis Ref.
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