input word = C00012054

Metabolite InformationStructural formula
Name [3aS-(3aalpha,4alpha,5beta,6beta,7alpha,7aalph)]- 6-Ethenyloctahydro-3a,4-dihydroxy-6-methyl-3-methylene-7-(1-methylethenyl)-2-oxo-5-benzofuranyl ester 3-methyl-2-butenoic acid
Formula C20H26O6
Mw 362.17293856
CAS RN 88010-56-4
C_ID C00012054 ,
InChIKey XGUOXZLREBJKDX-ZOZYXRAMNA-N
InChICode InChI=1S/C20H26O6/c1-8-19(7)14(11(4)5)16-20(24,12(6)18(23)26-16)15(22)17(19)25-13(21)9-10(2)3/h8-9,14-17,22,24H,1,4,6H2,2-3,5,7H3/t14-,15-,16-,17-,19+,20+/m0/s1
SMILES [C@H]1([C@]2([C@H]([C@@H]([C@]([C@H]1OC(=O)C=C(C)C)(C=C)C)C(=C)C)OC(=O)C2=C)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeMontanoa atriplicifolia Ref.
zoom in