Vitas-M small molecule compound
6-chloro-4-ethyl-7-[2-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)-2-oxoethoxy]-2H-chromen-2-one
Catalog ID
STL547215
SMILES CCc1cc(=O)oc2c1cc(Cl)c(c2)OCC(=O)N1CCC2(C(C1)CCCC2)O
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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 C22H26ClNO5 MW 419.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26ClNO5/c1-2-14-9-21(26)29-18-11-19(17(23)10-16(14)18)28-13-20(25)24-8-7-22(27)6-4-3-5-15(22)12-24/h9-11,15,27H,2-8,12-13H2,1H3InChIKey
FSUVYUNLVBJENN-UHFFFAOYSA-NSynonyms
4553787
6chloro4ethyl7(2(4ahydroxyoctahydroisoquinolin2(1H)yl)2oxoethoxy)2Hchromen2one
7(2(4~(a)hydroxy13456788~(a)octahydroisoquinolin2yl)2oxoethoxy)6chloro4ethylchromen2one
InChI=1SC22H26ClNO5c1214921(26)29181119(17(23)1016(14)18)281320(25)248722(27)643515(22)1224h9111527H281213H21H3
MFCD31756529
ZINC000002109145
ZINC000006708298
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