input word = C00022236

Metabolite InformationStructural formula
Name 3alpha,15-Dihydroxy-ent-labda-7,13E-dien-2-one
Formula C20H32O3
Mw 320.23514489
CAS RN 120838-06-4
C_ID C00022236 ,
InChIKey RMFOHDNAEOCEQV-WBUDAKACNA-N
InChICode InChI=1S/C20H32O3/c1-13(10-11-21)6-8-15-14(2)7-9-17-19(3,4)18(23)16(22)12-20(15,17)5/h7,10,15,17-18,21,23H,6,8-9,11-12H2,1-5H3/b13-10+/t15-,17-,18-,20-/m1/s1
SMILES CC1=CC[C@@H]2C(C)(C)[C@H](O)C(=O)C[C@@]2(C)[C@@H]1CC/C(C)=C/CO
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeBaccharis boliviensis Ref.
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