Vitas-M small molecule compound
1-(6-tert-butyl-1,1-dimethyl-2,3-dihydro-1H-inden-4-yl)-2-(4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-5-yl)ethanone
Catalog ID
STL526383
SMILES COc1c2c(CCN(C2CC(=O)c2cc(cc3c2CCC3(C)C)C(C)(C)C)C)cc2c1OCO2
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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 C29H37NO4 MW 463.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H37NO4/c1-28(2,3)18-13-20(19-8-10-29(4,5)21(19)14-18)23(31)15-22-25-17(9-11-30(22)6)12-24-26(27(25)32-7)34-16-33-24/h12-14,22H,8-11,15-16H2,1-7H3InChIKey
WXYFVBJAJSSMPP-UHFFFAOYSA-NSynonyms
895905-85-81(6(tertbutyl)11dimethyl23dihydro1Hinden4yl)2(4methoxy6methyl5678tetrahydro(13)dioxolo(45g)isoquinolin5yl)ethanone
1(6~(tert)butyl11dimethyl23dihydroinden4yl)2(4methoxy6methyl78dihydro5~(H)(13)dioxolo(45g)isoquinolin5yl)ethanone
1(6tertbutyl11dimethyl23dihydro1Hinden4yl)2(4methoxy6methyl5678tetrahydro(13)dioxolo(45g)isoquinolin5yl)ethanone
1(6TERTBUTYL11DIMETHYL23DIHYDROINDEN4YL)2(4METHOXY6METHYL78DIHYDRO5H(13)DIOXOLO(45G)ISOQUINOLIN5YL)ETHANONE
3724850
895905858
InChI=1SC29H37NO4c128(23)181320(1981029(45)21(19)1418)23(31)15222517(91130(22)6)122426(27(25)327)34163324h121422H8111516H217H3
MFCD02115743
ZINC000020111972
ZINC000020111974
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