Vitas-M small molecule compound
3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-6-ethyl-7-[(4-fluorobenzyl)oxy]-4H-chromen-4-one
Catalog ID
STK844928
SMILES CCc1cc2c(cc1OCc1ccc(cc1)F)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 C27H23FO5 MW 446.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23FO5/c1-2-18-12-21-25(14-24(18)32-15-17-4-7-20(28)8-5-17)33-16-22(27(21)29)19-6-9-23-26(13-19)31-11-3-10-30-23/h4-9,12-14,16H,2-3,10-11,15H2,1H3InChIKey
NRKVLBUFRSZMLD-UHFFFAOYSA-NSynonyms
610750-56-63(2H3H4HBENZO(B)14DIOXEPAN7YL)6ETHYL7((4FLUOROPHENYL)METHOXY)CHROMEN4ONE
3(34dihydro2H15benzodioxepin7yl)6ethyl7((4fluorobenzyl)oxy)4Hchromen4one
3(34DIHYDRO2H15BENZODIOXEPIN7YL)6ETHYL7((4FLUOROPHENYL)METHOXY)CHROMEN4ONE
3(34dihydro2Hbenzo(b)(14)dioxepin7yl)6ethyl7((4fluorobenzyl)oxy)4Hchromen4one
610750566
CCC1=C(C=C2C(=C1)C(=O)C(=CO2)C3=CC4=C(C=C3)OCCCO4)OCC5=CC=C(C=C5)F
InChI=1SC27H23FO5c1218122125(1424(18)3215174720(28)8517)331622(27(21)29)19692326(1319)31113103023h49121416H23101115H21H3
MFCD04007108
ZINC000002264349
ZINC02264349
ZINC2264349
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