Vitas-M small molecule compound
propan-2-yl 4-(3-bromo-5-ethoxy-4-hydroxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK402314
SMILES CCOc1cc(cc(c1O)Br)C1C(=C(C)NC2=C1C(=O)CCC2)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 C22H26BrNO5 MW 464.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26BrNO5/c1-5-28-17-10-13(9-14(23)21(17)26)19-18(22(27)29-11(2)3)12(4)24-15-7-6-8-16(25)20(15)19/h9-11,19,24,26H,5-8H2,1-4H3InChIKey
IDPMNNRUZGYOJG-UHFFFAOYSA-NSynonyms
CCOC1=C(C(=CC(=C1)C2C3=C(CCCC3=O)NC(=C2C(=O)OC(C)C)C)Br)O
InChI=1SC22H26BrNO5c1528171013(914(23)21(17)26)1918(22(27)2911(2)3)12(4)241576816(25)20(15)19h911192426H58H214H3
MFCD01367209
propan2yl4(3bromo5ethoxy4hydroxyphenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
propan2yl4(3bromo5ethoxy4hydroxyphenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
ZINC000006195741
ZINC000006195778
Check stock
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