input word = C00000468

Metabolite InformationStructural formula
Name (3E)-Dactomelyne
Formula C15H20BrClO2
Mw 346.03352049
CAS RN 79373-29-8
C_ID C00000468 ,
InChIKey NVMRARRBFWEZAC-CBPQCXIENA-N
InChICode InChI=1S/C15H20BrClO2/c1-3-5-6-7-13-11(17)9-15-14(19-13)8-10(16)12(4-2)18-15/h1,5-6,10-15H,4,7-9H2,2H3/b6-5+/t10-,11+,12+,13+,14-,15-/m1/s1
SMILES C#C/C=C/C[C@@H]1O[C@@H]2C[C@@H](Br)[C@H](CC)O[C@@H]2C[C@@H]1Cl
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
AnimaliaAplysiidaeAplysia dactylomela Ref.
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