Vitas-M small molecule compound
methyl 3-butanoyl-4-[(2,4-dimethoxyphenyl)amino]-6,6-dimethyl-2-oxocyclohex-3-ene-1-carboxylate
Catalog ID
STL298157
SMILES CCCC(=O)C1=C(Nc2ccc(cc2OC)OC)CC(C(C1=O)C(=O)OC)(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 C22H29NO6 MW 403.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H29NO6/c1-7-8-16(24)18-15(12-22(2,3)19(20(18)25)21(26)29-6)23-14-10-9-13(27-4)11-17(14)28-5/h9-11,19,23H,7-8,12H2,1-6H3InChIKey
IGZWWFHRBRLZIM-UHFFFAOYSA-NSynonyms
CCCC(=O)C1=C(CC(C(C1=O)C(=O)OC)(C)C)NC2=C(C=C(C=C2)OC)OC
InChI=1SC22H29NO6c17816(24)1815(1222(23)19(20(18)25)21(26)296)231410913(274)1117(14)285h9111923H7812H216H3
methyl3butanoyl4((24dimethoxyphenyl)amino)66dimethyl2oxocyclohex3ene1carboxylate
METHYL3BUTANOYL4(24DIMETHOXYANILINO)66DIMETHYL2OXOCYCLOHEX3ENE1CARBOXYLATE
methyl3butyryl4((24dimethoxyphenyl)amino)66dimethyl2oxocyclohex3enecarboxylate
MFCD00512912
ZINC000000805853
ZINC000000805854
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