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Speciociliatine

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For Research Use Only | Not For Clinical Use
CATAPS14382797
CAS14382-79-7
Structure
IUPAC Namemethyl (E)-2-[(2S,3S,12bR)-3-ethyl-8-methoxy-1,2,3,4,6,7,12,12b-octahydroindolo[2,3-a]quinolizin-2-yl]-3-methoxyprop-2-enoate
Molecular Weight398.50
Molecular FormulaC23H30N2O4
Canonical SMILESCC[C@@H]1CN2CCc3c([nH]c4cccc(OC)c34)[C@H]2C[C@@H]1\C(=C/OC)\C(=O)OC
InChIInChI=1S/C23H30N2O4/c1-5-14-12-25-10-9-15-21-18(7-6-8-20(21)28-3)24-22(15)19(25)11-16(14)17(13-27-2)23(26)29-4/h6-8,13-14,16,19,24H,5,9-12H2,1-4H3/b17-13+/t14-,16+,19-/m1/s1
Accurate Mass398.2206
FormatNeat
SubcategoryChiral molecules, Neurochemicals
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