Vitas-M small molecule compound
3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-6-ethyl-7-[(3-methoxybenzyl)oxy]-4H-chromen-4-one
Catalog ID
STK888477
SMILES CCc1cc2c(cc1OCc1cccc(c1)OC)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 C28H26O6 MW 458.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26O6/c1-3-19-13-22-26(15-25(19)33-16-18-6-4-7-21(12-18)30-2)34-17-23(28(22)29)20-8-9-24-27(14-20)32-11-5-10-31-24/h4,6-9,12-15,17H,3,5,10-11,16H2,1-2H3InChIKey
DHDLPZCPMKUWOE-UHFFFAOYSA-NSynonyms
610751-68-33(2H3H4HBENZO(B)14DIOXEPAN7YL)6ETHYL7((3METHOXYPHENYL)METHOXY)CHROMEN4ONE
3(34dihydro2H15benzodioxepin7yl)6ethyl7((3methoxybenzyl)oxy)4Hchromen4one
3(34DIHYDRO2H15BENZODIOXEPIN7YL)6ETHYL7((3METHOXYPHENYL)METHOXY)CHROMEN4ONE
3(34dihydro2Hbenzo(b)(14)dioxepin7yl)6ethyl7((3methoxybenzyl)oxy)4Hchromen4one
610751683
CCC1=C(C=C2C(=C1)C(=O)C(=CO2)C3=CC4=C(C=C3)OCCCO4)OCC5=CC(=CC=C5)OC
InChI=1SC28H26O6c1319132226(1525(19)33161864721(1218)302)341723(28(22)29)20892427(1420)32115103124h469121517H35101116H212H3
MFCD03660574
ZINC000001321201
ZINC01321201
ZINC1321201
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