Vitas-M small molecule compound
methyl (4Z)-5-butanoyl-4-(ethoxyimino)-2,2-dimethyl-6-oxocyclohexanecarboxylate
Catalog ID
STL560735
SMILES CCCC(=O)C1/C(=N\OCC)/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 C16H25NO5 MW 311.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H25NO5/c1-6-8-11(18)12-10(17-22-7-2)9-16(3,4)13(14(12)19)15(20)21-5/h12-13H,6-9H2,1-5H3/b17-10-InChIKey
WULKMVHJDWOWAT-YVLHZVERSA-NSynonyms
(Z)methyl5butyryl4(ethoxyimino)22dimethyl6oxocyclohexanecarboxylate
5718927
CCCC(=O)C1C(=NOCC)CC(C(C1=O)C(=O)OC)(C)C
InChI=1SC16H25NO5c16811(18)1210(172272)916(34)13(14(12)19)15(20)215h1213H69H215H3b1710
methyl(4Z)5butanoyl4(ethoxyimino)22dimethyl6oxocyclohexanecarboxylate
methyl(4Z)5butanoyl4ethoxyimino22dimethyl6oxocyclohexane1carboxylate
MFCD01548725
ZINC000100162635
ZINC000100743227
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