input word = C00038611

Metabolite InformationStructural formula
Name Boehmerol acetate
Formula C32H52O2
Mw 468.3967309
CAS RN 123409-83-6
C_ID C00038611 ,
InChIKey LVDIOSHGTKUVMX-VGHIVREWNA-N
InChICode InChI=1S/C32H52O2/c1-20(2)22-10-11-23-24-12-13-26-30(7)16-15-27(34-21(3)33)28(4,5)25(30)14-17-32(26,9)31(24,8)19-18-29(22,23)6/h20,22,25-27H,10-19H2,1-9H3/t22-,25-,26-,27-,29-,30-,31-,32-/m0/s1
SMILES CC(=O)O[C@H]1CC[C@@]2(C)[C@@H](CC[C@@]3(C)[C@H]2CCC2=C4CC[C@@H](C(C)C)[C@]4(C)CC[C@@]23C)C1(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaePluchea sericea Ref.
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