Vitas-M small molecule compound
3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-6-ethyl-7-(2-oxo-2-phenylethoxy)-4H-chromen-4-one
Catalog ID
STK889010
SMILES CCc1cc2c(cc1OCC(=O)c1ccccc1)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 C28H24O6 MW 456.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H24O6/c1-2-18-13-21-26(15-25(18)34-17-23(29)19-7-4-3-5-8-19)33-16-22(28(21)30)20-9-10-24-27(14-20)32-12-6-11-31-24/h3-5,7-10,13-16H,2,6,11-12,17H2,1H3InChIKey
DOUSKSVPHNNQKP-UHFFFAOYSA-NSynonyms
610763-36-53(2H3H4HBENZO(B)14DIOXEPAN7YL)6ETHYL7(2OXO2PHENYLETHOXY)CHROMEN4ONE
3(34dihydro2H15benzodioxepin7yl)6ethyl7(2oxo2phenylethoxy)4Hchromen4one
3(34DIHYDRO2H15BENZODIOXEPIN7YL)6ETHYL7PHENACYLOXYCHROMEN4ONE
3(34DIHYDRO2HBENZO(B)(14)DIOXEPIN7YL)6ETHYL7(2OXO2PHENYLETHOXY)4HCHROMEN4ONE
610763365
CCC1=C(C=C2C(=C1)C(=O)C(=CO2)C3=CC4=C(C=C3)OCCCO4)OCC(=O)C5=CC=CC=C5
InChI=1SC28H24O6c1218132126(1525(18)341723(29)197435819)331622(28(21)30)209102427(1420)32126113124h357101316H26111217H21H3
MFCD04145602
ZINC000001454468
ZINC01454468
ZINC1454468
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