input word = C00020406

Metabolite InformationStructural formula
Name 11-Acetoxy-10(14)-guaien-4alpha-ol
Formula C17H28O3
Mw 280.20384476
CAS RN 74799-29-4
C_ID C00020406 ,
InChIKey BVCFBFNQCMEHNS-CNSJDJIMNA-N
InChICode InChI=1S/C17H28O3/c1-11-6-7-13(16(3,4)20-12(2)18)10-15-14(11)8-9-17(15,5)19/h13-15,19H,1,6-10H2,2-5H3/t13-,14+,15-,17-/m1/s1
SMILES [C@@H]12[C@@H](CC[C@@]1(C)O)C(=C)CC[C@H](C2)C(C)(C)OC(=O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeChenopodiaceaeChenopodium botrys Ref.
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OrganismChenopodium botrys
Referencede Pascual,Tetrahedron,36,(1980),371