Vitas-M small molecule compound
methyl 3-butanoyl-6,6-dimethyl-2-oxo-4-(pyrrolidin-1-yl)cyclohex-3-ene-1-carboxylate
Catalog ID
STL297959
SMILES CCCC(=O)C1=C(CC(C(C1=O)C(=O)OC)(C)C)N1CCCC1
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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 C18H27NO4 MW 321.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H27NO4/c1-5-8-13(20)14-12(19-9-6-7-10-19)11-18(2,3)15(16(14)21)17(22)23-4/h15H,5-11H2,1-4H3InChIKey
UWSUHRCVVNJKBR-UHFFFAOYSA-NSynonyms
123299-38-7123299387
3BUTYRYL66DIMETHYL2OXO4PYRROLIDIN1YLCYCLOHEX3ENECARBOXYLICACIDMETHYLESTER
CCCC(=O)C1=C(CC(C(C1=O)C(=O)OC)(C)C)N2CCCC2
InChI=1SC18H27NO4c15813(20)1412(199671019)1118(23)15(16(14)21)17(22)234h15H511H214H3
METHYL3BUTANOYL66DIMETHYL2OXO4(PYRROLIDIN1YL)CYCLOHEX3ENE1CARBOXYLATE
METHYL3BUTANOYL66DIMETHYL2OXO4PYRROLIDIN1YLCYCLOHEX3ENE1CARBOXYLATE
METHYL3BUTANOYL66DIMETHYL2OXO4PYRROLIDINYLCYCLOHEX3ENECARBOXYLATE
methyl3butyryl66dimethyl2oxo4(pyrrolidin1yl)cyclohex3enecarboxylate
MFCD00512872
ZINC000000294728
ZINC000000294729
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