input word = C00021759

Metabolite InformationStructural formula
Name Vetivenic acid
Zizanoic acid
Formula C15H22O2
Mw 234.16197995
CAS RN 16203-25-1
C_ID C00021759 ,
InChIKey IJGMVUXEZUEDJR-VTTZNTHLNA-N
InChICode InChI=1S/C15H22O2/c1-9-11-4-5-12(13(16)17)15(11)7-6-10(8-15)14(9,2)3/h10-12H,1,4-8H2,2-3H3,(H,16,17)/t10-,11-,12-,15+/m1/s1
SMILES C1[C@@H]([C@]23[C@H](C1)C(=C)C([C@@H](C2)CC3)(C)C)C(=O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeArtemisia annua Ref.
PlantaePoaceaeVetiveria zizanioides Ref.
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