input word = C00017506

Metabolite InformationStructural formula
Name 3-Methoxycacalonol
6-Methoxycacalonol
Formula C16H16O4
Mw 272.104859
CAS RN 58880-00-5
C_ID C00017506 ,
InChIKey HCDROHXQHZUWFS-UHFFFAOYNA-N
InChICode InChI=1S/C16H16O4/c1-8-7-20-15-12(8)16(3,18)13-9(2)11(19-4)6-5-10(13)14(15)17/h5-7,18H,1-4H3/t16-/m1/s1
SMILES COc1ccc2c(c1C)C(C)(O)c1c(C)coc1C2=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeCacalia delphiniifolia Ref.
zoom in