Vitas-M small molecule compound
(2E)-3-[(1S)-6-hydroxy-7-methoxy-1-methyl-3,4-dihydroisoquinolin-2(1H)-yl]-1-(4-methoxyphenyl)prop-2-en-1-one
Catalog ID
STL525854
SMILES COc1ccc(cc1)C(=O)/C=C/N1CCc2c([C@@H]1C)cc(c(c2)O)OC
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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 C21H23NO4 MW 353.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23NO4/c1-14-18-13-21(26-3)20(24)12-16(18)8-10-22(14)11-9-19(23)15-4-6-17(25-2)7-5-15/h4-7,9,11-14,24H,8,10H2,1-3H3/b11-9+/t14-/m0/s1InChIKey
CLJHHIMFBPOUKU-MARXPDLDSA-NSynonyms
(~(E))3((1~(S))6hydroxy7methoxy1methyl34dihydro1~(H)isoquinolin2yl)1(4methoxyphenyl)prop2en1one
(2E)3((1S)6hydroxy7methoxy1methyl34dihydroisoquinolin2(1H)yl)1(4methoxyphenyl)prop2en1one
(E)3((1S)6HYDROXY7METHOXY1METHYL34DIHYDRO1HISOQUINOLIN2YL)1(4METHOXYPHENYL)PROP2EN1ONE
(RE)3(6hydroxy7methoxy1methyl34dihydroisoquinolin2(1H)yl)1(4methoxyphenyl)prop2en1one
6570894
COc1ccc(cc1)C(=O)C=CN1CCc2c((C@H)1C)cc(c(c2)O)OC
InChI=1SC21H23NO4c114181321(263)20(24)1216(18)81022(14)11919(23)154617(252)7515h479111424H810H213H3b119+t14m0s1
MFCD02115030
ZINC000004028230
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