Vitas-M small molecule compound
19-[2-(4-chlorophenyl)-2-oxoethyl]strychnidin-19-ium-10-one
Catalog ID
STL558119
SMILES Clc1ccc(cc1)C(=O)C[N+]12CCC34C2CC2C(=CCOC5C2C4N(c2c3cccc2)C(=O)C5)C1
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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 C29H28ClN2O3 MW 488.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H28ClN2O3/c30-19-7-5-17(6-8-19)23(33)16-32-11-10-29-21-3-1-2-4-22(21)31-26(34)14-24-27(28(29)31)20(13-25(29)32)18(15-32)9-12-35-24/h1-9,20,24-25,27-28H,10-16H2/q+1InChIKey
MSYMCKLPOMNBQJ-UHFFFAOYSA-NSynonyms
(4aR4a1R5aS6S8aS8a1S15aS)6(2(4chlorophenyl)2oxoethyl)14oxo24a4a155a6788a1141515adodecahydro46methanoindolo(321ij)oxepino(234de)pyrrolo(23h)quinolin6iumchloride
19(2(4chlorophenyl)2oxoethyl)strychnidin19ium10one
5149887
6(2(4chlorophenyl)2oxoethyl)4~(a)55~(a)7813~(a)1515~(a)15~(b)16decahydro2~(H)46methanoindolo(321ij)oxepino(234de)pyrrolo(23h)quinolin6ium14one
Clc1ccc(cc1)C(=O)C(N+)12CC(C@)34(C@@H)2C(C@H)2C(=CCO(C@@H)5(C@H)2(C@@H)4N(c2c3cccc2)C(=O)C5)C1(Cl)
InChI=1SC29H28ClN2O3c30197517(6819)23(33)163211102921312422(21)3126(34)142427(28(29)31)20(1325(29)32)18(1532)9123524h192024252728H1016H2q+1
MFCD09266801
ZINC000245240181
ZINC000245240187
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