input word = C00022381

Metabolite InformationStructural formula
Name 19-Hydroxy-13-epimanoyl oxide
Formula C20H34O2
Mw 306.25588033
CAS RN 77096-88-9
C_ID C00022381 ,
InChIKey MONXCRDSDZQGGT-HSBYLURSNA-N
InChICode InChI=1S/C20H34O2/c1-6-18(3)12-8-16-19(4)11-7-10-17(2,14-21)15(19)9-13-20(16,5)22-18/h6,15-16,21H,1,7-14H2,2-5H3/t15-,16+,17+,18+,19-,20+/m0/s1
SMILES C1C[C@]([C@H]2[C@](C1)([C@@H]1[C@@](CC2)(O[C@@](CC1)(C=C)C)C)C)(C)CO
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeBaccharis tola Ref.
zoom in



OrganismBaccharis tola
ReferenceSan Martin,Phytochem.,19,(1980),1985