Vitas-M small molecule compound
6-({[3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-benzofuran-5-yl]oxy}acetyl)-4-methyl-2H-1,4-benzoxazin-3(4H)-one
Catalog ID
STL408271
SMILES O=C(c1ccc2c(c1)N(C)C(=O)CO2)COc1ccc2c(c1)c(co2)c1ccc2c(c1)OCCCO2
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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 C28H23NO7 MW 485.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H23NO7/c1-29-22-11-18(4-6-25(22)36-16-28(29)31)23(30)15-34-19-5-8-24-20(13-19)21(14-35-24)17-3-7-26-27(12-17)33-10-2-9-32-26/h3-8,11-14H,2,9-10,15-16H2,1H3InChIKey
DUTMMJHXZOIITF-UHFFFAOYSA-NSynonyms
1574299-86-71574299867
6(((3(34dihydro2H15benzodioxepin7yl)1benzofuran5yl)oxy)acetyl)4methyl2H14benzoxazin3(4H)one
6(2((3(34dihydro2H15benzodioxepin7yl)1benzofuran5yl)oxy)acetyl)4methyl14benzoxazin3one
6(2((3(34dihydro2Hbenzo(b)(14)dioxepin7yl)benzofuran5yl)oxy)acetyl)4methyl2Hbenzo(b)(14)oxazin3(4H)one
CN1C(=O)COC2=C1C=C(C=C2)C(=O)COC3=CC4=C(C=C3)OC=C4C5=CC6=C(C=C5)OCCCO6
InChI=1SC28H23NO7c129221118(4625(22)361628(29)31)23(30)153419582420(1319)21(143524)17372627(1217)3310293226h381114H29101516H21H3
MFCD28058868
ZINC000096231615
ZINC96231615
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