Vitas-M small molecule compound
1-[(4aR,6S,8aR)-1'-ethyl-4,4a,5,6-tetrahydrospiro[6,8a-epoxyisoquinoline-3,4'-piperidin]-2(1H)-yl]ethanone
Catalog ID
STL552881
SMILES CCN1CCC2(CC1)C[C@@H]1C[C@H]3O[C@@]1(CN2C(=O)C)C=C3
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C17H26N2O2 MW 290.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H26N2O2/c1-3-18-8-6-16(7-9-18)11-14-10-15-4-5-17(14,21-15)12-19(16)13(2)20/h4-5,14-15H,3,6-12H2,1-2H3/t14-,15+,17+/m0/s1InChIKey
ILVPOFGJZSFGPB-ZMSDIMECSA-NSynonyms
462113-60-61((1~(R)6~(R)8~(S))1ethylspiro(11oxa3azatricyclo(6210^(16))undec9ene44piperidine)3yl)ethanone
1((4aR6S8aR)1ethyl44a56tetrahydrospiro(68aepoxyisoquinoline34piperidin)2(1H)yl)ethanone
462113606
875878
CCN1CCC2(CC1)C(C@@H)1C(C@@H)3O(C@@)1(CN2C(=O)C)C=C3
InChI=1SC17H26N2O2c13188616(7918)111410154517(142115)1219(16)13(2)20h451415H3612H212H3t1415+17+m0s1
ZINC000000444298
ZINC444298
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