input word = C00011014

Metabolite InformationStructural formula
Name Vulgarole
Formula C12H20O3
Mw 212.1412445
CAS RN 61586-52-5
C_ID C00011014 ,
InChIKey QRRSWTCVSAQEPQ-UHFFFAOYNA-N
InChICode InChI=1S/C12H20O3/c1-7(13)15-10-9(14)8-5-6-12(10,4)11(8,2)3/h8-10,14H,5-6H2,1-4H3/t8-,9-,10-,12+/m0/s1
SMILES [C@H]12CC[C@@]([C@H]([C@H]1O)OC(=O)C)(C)C2(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeArtemisia vulgaris Ref.
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OrganismArtemisia vulgaris
ReferenceNano,Planta Med.,30,(1976),211