Vitas-M small molecule compound
4-[({[3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-4-oxo-4H-chromen-7-yl]oxy}acetyl)amino]butanoic acid
Catalog ID
STK024890
SMILES O=C(COc1ccc2c(c1)oc(c(c2=O)c1ccc2c(c1)OCCCO2)C)NCCCC(=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 C25H25NO8 MW 467.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25NO8/c1-15-24(16-5-8-19-21(12-16)32-11-3-10-31-19)25(30)18-7-6-17(13-20(18)34-15)33-14-22(27)26-9-2-4-23(28)29/h5-8,12-13H,2-4,9-11,14H2,1H3,(H,26,27)(H,28,29)InChIKey
JVBYXBAFBADJRO-UHFFFAOYSA-NSynonyms
374704-43-5374704435
4((((3(34DIHYDRO2H15BENZODIOXEPIN7YL)2METHYL4OXO4HCHROMEN7YL)OXY)ACETYL)AMINO)BUTANOICACID
4((2(3(34DIHYDRO2H15BENZODIOXEPIN7YL)2METHYL4OXOCHROMEN7YL)OXYACETYL)AMINO)BUTANOICACID
4(2((3(34dihydro2Hbenzo(b)(14)dioxepin7yl)2methyl4oxo4Hchromen7yl)oxy)acetamido)butanoicacid
CC1=C(C(=O)C2=C(O1)C=C(C=C2)OCC(=O)NCCCC(=O)O)C3=CC4=C(C=C3)OCCCO4
InChI=1SC25H25NO8c11524(16581921(1216)32113103119)25(30)187617(1320(18)3415)331422(27)2692423(28)29h581213H2491114H21H3(H2627)(H2829)
MFCD01548091
O=C(COc1ccc2c(c1)oc(c(c2=O)c1ccc2c(c1)OCCCO2)C)NCCCC(=O)O
STK024890
ZINC000002138963
ZINC2138963
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