Vitas-M small molecule compound
methyl 4-{4-hydroxy-1-[3-(1H-imidazol-1-yl)propyl]-3-[(2-methyl-2,3-dihydro-1-benzofuran-5-yl)carbonyl]-5-oxo-2,5-dihydro-1H-pyrrol-2-yl}benzoate
Catalog ID
STK881799
SMILES COC(=O)c1ccc(cc1)C1N(CCCn2cncc2)C(=O)C(=C1C(=O)c1ccc2c(c1)CC(O2)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 C28H27N3O6 MW 501.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H27N3O6/c1-17-14-21-15-20(8-9-22(21)37-17)25(32)23-24(18-4-6-19(7-5-18)28(35)36-2)31(27(34)26(23)33)12-3-11-30-13-10-29-16-30/h4-10,13,15-17,24,33H,3,11-12,14H2,1-2H3InChIKey
KIRCESJJXSXZFT-UHFFFAOYSA-NSynonyms
methyl4(1(3(1Himidazol1yl)propyl)4hydroxy3(2methyl23dihydrobenzofuran5carbonyl)5oxo25dihydro1Hpyrrol2yl)benzoate
methyl4(4hydroxy1(3(1Himidazol1yl)propyl)3((2methyl23dihydro1benzofuran5yl)carbonyl)5oxo25dihydro1Hpyrrol2yl)benzoate
MFCD04009624
ZINC000015934681
ZINC000015934684
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