input word = C00022336

Metabolite InformationStructural formula
Name 16-Acetoxycarterochaetol
Formula C22H36O4
Mw 364.26135964
CAS RN 74513-37-4
C_ID C00022336 ,
InChIKey FGEVYIKISBOJQP-OINSFGQGNA-N
InChICode InChI=1S/C22H36O4/c1-15(24)25-14-16(8-12-23)17-13-19-21(4)10-6-9-20(2,3)18(21)7-11-22(19,5)26-17/h8,17-19,23H,6-7,9-14H2,1-5H3/b16-8-/t17-,18-,19+,21-,22+/m1/s1
SMILES C1CC([C@@H]2[C@@](C1)([C@H]1[C@](CC2)(O[C@H](C1)/C(=C\CO)/COC(=O)C)C)C)(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeSilphium perfoliatum Ref.
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OrganismSilphium perfoliatum
ReferenceBohlmann,Phytochem.,18,(1979),1987