input word = C00021325

Metabolite InformationStructural formula
Name Vulgarone B
Formula C15H22O
Mw 218.16706532
CAS RN 64180-68-3
C_ID C00021325 ,
InChIKey KTPOZFYJWLGJGH-UHFFFAOYNA-N
InChICode InChI=1S/C15H22O/c1-9-8-10(16)12-13-11(9)15(12,4)7-5-6-14(13,2)3/h8,11-13H,5-7H2,1-4H3/t11-,12+,13-,15+/m1/s1
SMILES C1=C([C@@H]2[C@@H]3[C@H](C1=O)[C@]2(CCCC3(C)C)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeAchillea millefolium Ref.
PlantaeAsteraceaeChrysanthemum vulgare Ref.
PlantaeAsteraceaeTanacetum tanacetioides Ref.
zoom in