input word = C00022782

Metabolite InformationStructural formula
Name 2alpha-Hydroxy-3alpha,4alpha-epoxy-ent-cleroda-13(16),14-diene-15,16-oxide
Formula C20H30O3
Mw 318.21949482
CAS RN 120838-02-0
C_ID C00022782 ,
InChIKey ULXIIKXFUKQSBU-LGKVIMDSNA-N
InChICode InChI=1S/C20H30O3/c1-13-5-9-19(3)16(11-15(21)17-20(19,4)23-17)18(13,2)8-6-14-7-10-22-12-14/h7,10,12-13,15-17,21H,5-6,8-9,11H2,1-4H3/t13-,15-,16-,17-,18+,19-,20-/m1/s1
SMILES C[C@@H]1CC[C@]2(C)[C@H](C[C@@H](O)[C@H]3O[C@]32C)[C@@]1(C)CCc1ccoc1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeBaccharis boliviensis Ref.
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