input word = C00012689

Metabolite InformationStructural formula
Name Brasudol
[2R-(2alpha,4aalpha,5alpha,8abeta)]-5-Bromodecahydro-a,a,4a-trimethyl-8-methylene-2-naphthalenemethanol
Formula C15H25BrO
Mw 300.10887832
CAS RN 72154-35-9
C_ID C00012689 ,
InChIKey AREFYVKPYJWXLV-GMMMMNJQNA-N
InChICode InChI=1S/C15H25BrO/c1-10-5-6-13(16)15(4)8-7-11(9-12(10)15)14(2,3)17/h11-13,17H,1,5-9H2,2-4H3/t11-,12+,13-,15-/m1/s1
SMILES [C@H]1(CCC(=C)[C@H]2[C@]1(CC[C@H](C2)C(C)(C)O)C)Br
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
AnimaliaAplysiidaeAplysia brasiliana Ref.
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