Vitas-M small molecule compound
3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-6-ethyl-4-oxo-4H-chromen-7-yl furan-2-carboxylate
Catalog ID
STK888711
SMILES CCc1cc2c(cc1OC(=O)c1ccco1)occ(c2=O)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 C25H20O7 MW 432.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20O7/c1-2-15-11-17-22(13-21(15)32-25(27)20-5-3-8-29-20)31-14-18(24(17)26)16-6-7-19-23(12-16)30-10-4-9-28-19/h3,5-8,11-14H,2,4,9-10H2,1H3InChIKey
NBTUIIOMVQKJBK-UHFFFAOYSA-NSynonyms
610752-59-5(3(34DIHYDRO2H15BENZODIOXEPIN7YL)6ETHYL4OXOCHROMEN7YL)FURAN2CARBOXYLATE
3(2H3H4HBENZO(B)14DIOXEPAN7YL)6ETHYL4OXOCHROMEN7YLFURAN2CARBOXYLATE
3(34DIHYDRO2H15BENZODIOXEPIN7YL)6ETHYL4OXO4HCHROMEN7YL2FUROATE
3(34dihydro2H15benzodioxepin7yl)6ethyl4oxo4Hchromen7ylfuran2carboxylate
3(34DIHYDRO2HBENZO(B)(14)DIOXEPIN7YL)6ETHYL4OXO4HCHROMEN7YLFURAN2CARBOXYLATE
610752595
CCC1=C(C=C2C(=C1)C(=O)C(=CO2)C3=CC4=C(C=C3)OCCCO4)OC(=O)C5=CC=CO5
InChI=1SC25H20O7c1215111722(1321(15)3225(27)205382920)311418(24(17)26)16671923(1216)3010492819h3581114H24910H21H3
MFCD03696017
ZINC000000728010
ZINC00728010
ZINC728010
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