Vitas-M small molecule compound
ethyl (3S)-3-[2-(4-fluorophenyl)-2-oxoethyl]-2-oxo-4-phenyl-3,4-dihydro-2H-chromene-3-carboxylate
Catalog ID
STK841260
SMILES CCOC(=O)[C@@]1(CC(=O)c2ccc(cc2)F)C(=O)Oc2c(C1c1ccccc1)cccc2
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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 C26H21FO5 MW 432.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21FO5/c1-2-31-24(29)26(16-21(28)17-12-14-19(27)15-13-17)23(18-8-4-3-5-9-18)20-10-6-7-11-22(20)32-25(26)30/h3-15,23H,2,16H2,1H3/t23?,26-/m0/s1InChIKey
XDNIGSIBLAUGCL-NASUQTAISA-NSynonyms
1212430-00-6(3S)ethyl3(2(4fluorophenyl)2oxoethyl)2oxo4phenylchroman3carboxylate
1212430006
CCOC(=O)(C@@)1(CC(=O)c2ccc(cc2)F)C(=O)Oc2c(C1c1ccccc1)cccc2
CCOC(=O)C1(C(C2=CC=CC=C2OC1=O)C3=CC=CC=C3)CC(=O)C4=CC=C(C=C4)F
ethyl(3S)3(2(4fluorophenyl)2oxoethyl)2oxo4phenyl34dihydro2Hchromene3carboxylate
ethyl(3S)3(2(4fluorophenyl)2oxoethyl)2oxo4phenyl4Hchromene3carboxylate
InChI=1SC26H21FO5c123124(29)26(1621(28)17121419(27)151317)23(188435918)2010671122(20)3225(26)30h31523H216H21H3t23?26m0s1
MFCD18247016
ZINC000001158457
ZINC000001158459
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