input word = C00012785

Metabolite InformationStructural formula
Name Arctiol
[2S-(2alpha,3beta,4aalpha,8abeta)]-Decahydro-3-hydroxy-alpha,alpha,4a-trimethyl-8-methylene-2-naphthalenemethanol
Formula C15H26O2
Mw 238.19328007
CAS RN 36061-11-7
C_ID C00012785 ,
InChIKey WCAXUHZTOKKFKQ-SFJKVIHPNA-N
InChICode InChI=1S/C15H26O2/c1-10-6-5-7-15(4)9-13(16)12(8-11(10)15)14(2,3)17/h11-13,16-17H,1,5-9H2,2-4H3/t11-,12-,13-,15+/m0/s1
SMILES C=C1CCC[C@]2(C)C[C@H](O)[C@@H](C(C)(C)O)C[C@@H]12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeArctium lappa Ref.
PlantaeAsteraceaeLaggera alata Ref.
zoom in