Vitas-M small molecule compound
1-{2-[4-(ethoxycarbonyl)-2-methyl-4-(3-methylbutyl)-5-oxotetrahydrofuran-2-yl]-2-oxoethyl}pyridinium (non-preferred name)
Catalog ID
STK741153
SMILES CCOC(=O)C1(CCC(C)C)CC(OC1=O)(C)C(=O)C[n+]1ccccc1
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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 C20H28NO5 MW 362.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H28NO5/c1-5-25-17(23)20(10-9-15(2)3)14-19(4,26-18(20)24)16(22)13-21-11-7-6-8-12-21/h6-8,11-12,15H,5,9-10,13-14H2,1-4H3/q+1InChIKey
CDQRNCFTFIEAEK-UHFFFAOYSA-NSynonyms
1(2((2R4S)4(ETHOXYCARBONYL)2METHYL4(3METHYLBUTYL)5OXOTETRAHYDROFURAN2YL)2OXOETHYL)PYRIDINIUM(NONPREFERREDNAME)
1(2((2S4R)4(ETHOXYCARBONYL)2METHYL4(3METHYLBUTYL)5OXOTETRAHYDROFURAN2YL)2OXOETHYL)PYRIDINIUM(NONPREFERREDNAME)
1(2((2S4S)4(ETHOXYCARBONYL)2METHYL4(3METHYLBUTYL)5OXOTETRAHYDROFURAN2YL)2OXOETHYL)PYRIDINIUM(NONPREFERREDNAME)
1(2(4(ethoxycarbonyl)2methyl4(3methylbutyl)5oxotetrahydrofuran2yl)2oxoethyl)pyridinium(nonpreferredname)
1(2(4(ethoxycarbonyl)4isopentyl2methyl5oxotetrahydrofuran2yl)2oxoethyl)pyridin1iumbromide
CCOC(=O)C1(CC(OC1=O)(C)C(=O)C(N+)2=CC=CC=C2)CCC(C)C
CCOC(=O)C1(CCC(C)C)CC(OC1=O)(C)C(=O)C(n+)1ccccc1
CCOC(=O)C1(CCC(C)C)CC(OC1=O)(C)C(=O)C(n+)1ccccc1(Br)
ETHYL5METHYL3(3METHYLBUTYL)2OXO5(2PYRIDIN1IUM1YLACETYL)OXOLANE3CARBOXYLATE
InChI=1SC20H28NO5c152517(23)20(10915(2)3)1419(42618(20)24)16(22)1321117681221h68111215H59101314H214H3q+1
MFCD01550164
ZINC000001743547
ZINC000001743557
Check stock
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