Vitas-M small molecule compound
2-{5-[4-(3-hydroxy-6-methyl-4-oxo-4H-pyran-2-yl)-5-(4-methoxyphenyl)-1H-imidazol-2-yl]furan-2-yl}benzoic acid
Catalog ID
STL524024
SMILES COc1ccc(cc1)c1[nH]c(nc1c1oc(C)cc(=O)c1O)c1ccc(o1)c1ccccc1C(=O)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 C27H20N2O7 MW 484.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H20N2O7/c1-14-13-19(30)24(31)25(35-14)23-22(15-7-9-16(34-2)10-8-15)28-26(29-23)21-12-11-20(36-21)17-5-3-4-6-18(17)27(32)33/h3-13,31H,1-2H3,(H,28,29)(H,32,33)InChIKey
LCOMKQVBVFUUPU-UHFFFAOYSA-NSynonyms
135638639
2(5(4(3hydroxy6methyl4oxo4Hpyran2yl)5(4methoxyphenyl)1Himidazol2yl)furan2yl)benzoicacid
2(5(5(3hydroxy6methyl4oxo4Hpyran2yl)4(4methoxyphenyl)1Himidazol2yl)furan2yl)benzoicacid
2(5(5(3hydroxy6methyl4oxopyran2yl)4(4methoxyphenyl)1~(H)imidazol2yl)furan2yl)benzoicacid
COc1ccc(cc1)c1nc((nH)c1c1oc(C)cc(=O)c1O)c1ccc(o1)c1ccccc1C(=O)O
InChI=1SC27H20N2O7c1141319(30)24(31)25(3514)2322(157916(342)10815)2826(2923)21121120(3621)17534618(17)27(32)33h31331H12H3(H2829)(H3233)
MFCD31753450
ZINC001547138416
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