Vitas-M small molecule compound
ethyl 4-[3-acetyl-2-(4-boranylphenyl)-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]benzoate
Catalog ID
STK541298
SMILES CCOC(=O)c1ccc(cc1)N1C(=O)C(=C(C1c1ccc(cc1)B)C(=O)C)O
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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 C21H20BNO5 MW 377.20 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20BNO5/c1-3-28-21(27)14-6-10-16(11-7-14)23-18(13-4-8-15(22)9-5-13)17(12(2)24)19(25)20(23)26/h4-11,18,25H,3,22H2,1-2H3InChIKey
FDVIEXSRCMMDBQ-UHFFFAOYSA-NSynonyms
BC1=CC=C(C=C1)C2C(=C(C(=O)N2C3=CC=C(C=C3)C(=O)OCC)O)C(=O)C
ethyl4(3acetyl2(4boranylphenyl)4hydroxy5oxo25dihydro1Hpyrrol1yl)benzoate
ETHYL4(3ACETYL2(4BORANYLPHENYL)4HYDROXY5OXO2HPYRROL1YL)BENZOATE
ethyl4(3acetyl2(4borylphenyl)4hydroxy5oxo25dihydro1Hpyrrol1yl)benzoate
InChI=1SC21H20BNO5c132821(27)1461016(11714)2318(134815(22)9513)17(12(2)24)19(25)20(23)26h4111825H322H212H3
MFCD02158070
ZINC000195815950
ZINC000195815951
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