Vitas-M small molecule compound

ethyl 2-amino-4-(2,5-dimethoxyphenyl)-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carboxylate

Catalog ID
STK827883
SMILES CCOC(=O)C1=C(N)OC2=C(C1c1cc(OC)ccc1OC)C(=O)CC(C2)(C)C

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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 C22H27NO6 MW 401.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27NO6/c1-6-28-21(25)19-17(13-9-12(26-4)7-8-15(13)27-5)18-14(24)10-22(2,3)11-16(18)29-20(19)23/h7-9,17H,6,10-11,23H2,1-5H3
InChIKey
RJUDCTBXLQHQNH-UHFFFAOYSA-N
Synonyms
303189-40-4
303189404
CCOC(=O)C1=C(OC2=C(C1C3=C(C=CC(=C3)OC)OC)C(=O)CC(C2)(C)C)N
ethyl2amino4(25dimethoxyphenyl)77dimethyl5oxo5678tetrahydro4Hchromene3carboxylate
ETHYL2AMINO4(25DIMETHOXYPHENYL)77DIMETHYL5OXO68DIHYDRO4HCHROMENE3CARBOXYLATE
InChI=1SC22H27NO6c162821(25)1917(13912(264)7815(13)275)1814(24)1022(23)1116(18)2920(19)23h7917H6101123H215H3
MFCD00581340
ZINC000000629559
ZINC000004785441

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.