Vitas-M small molecule compound
3-(4-hydroxy-2-oxo-2H-chromen-3-yl)-N-[2-(1H-imidazol-4-yl)ethyl]-3-(3,4,5-trimethoxyphenyl)propanamide
Catalog ID
STL435925
SMILES COc1cc(cc(c1OC)OC)C(c1c(=O)oc2c(c1O)cccc2)CC(=O)NCCc1c[nH]cn1
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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 C26H27N3O7 MW 493.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N3O7/c1-33-20-10-15(11-21(34-2)25(20)35-3)18(12-22(30)28-9-8-16-13-27-14-29-16)23-24(31)17-6-4-5-7-19(17)36-26(23)32/h4-7,10-11,13-14,18,31H,8-9,12H2,1-3H3,(H,27,29)(H,28,30)InChIKey
BFVWMXQTCNXXRO-UHFFFAOYSA-NSynonyms
3(4hydroxy2oxo2Hchromen3yl)N(2(1Himidazol4yl)ethyl)3(345trimethoxyphenyl)propanamide
3(4hydroxy2oxochromen3yl)N(2(1Himidazol5yl)ethyl)3(345trimethoxyphenyl)propanamide
COC1=CC(=CC(=C1OC)OC)C(CC(=O)NCCC2=CN=CN2)C3=C(C4=CC=CC=C4OC3=O)O
COc1cc(cc(c1OC)OC)C(c1c(=O)oc2c(c1O)cccc2)CC(=O)NCCc1c(nH)cn1
InChI=1SC26H27N3O7c133201015(1121(342)25(20)353)18(1222(30)2898161327142916)2324(31)17645719(17)3626(23)32h47101113141831H8912H213H3(H2729)(H2830)
MFCD30711833
ZINC000253470524
ZINC000253470525
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