input word = C00044461

Metabolite InformationStructural formula
Name 5-Bromo-3-(3'-hydroxy-3'-methylpent-4'-enylidene)-2,4,4-trimethylcyclohexanone
Formula C15H23BrO2
Mw 314.08814288
CAS RN 636599-35-4
C_ID C00044461 ,
InChIKey WYSLNCUJDAJWAT-YRNVUSSQNA-N
InChICode InChI=1S/C15H23BrO2/c1-6-15(5,18)8-7-11-10(2)12(17)9-13(16)14(11,3)4/h6-7,10,13,18H,1,8-9H2,2-5H3/b11-7+/t10-,13+,15-/m0/s1
SMILES [C@H]1(CC(=O)[C@H](/C(=C\C[C@](C=C)(O)C)/C1(C)C)C)Br
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Laurencia obtusa Ref.
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