Vitas-M small molecule compound
3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-6-ethyl-2-methyl-7-[(4-methylbenzyl)oxy]-4H-chromen-4-one
Catalog ID
STK888614
SMILES CCc1cc2c(cc1OCc1ccc(cc1)C)oc(c(c2=O)c1ccc2c(c1)OCCCO2)C
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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 C29H28O5 MW 456.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H28O5/c1-4-21-14-23-26(16-25(21)33-17-20-8-6-18(2)7-9-20)34-19(3)28(29(23)30)22-10-11-24-27(15-22)32-13-5-12-31-24/h6-11,14-16H,4-5,12-13,17H2,1-3H3InChIKey
FYRKKAXDTBNMTN-UHFFFAOYSA-NSynonyms
610761-30-33(34dihydro2H15benzodioxepin7yl)6ethyl2methyl7((4methylbenzyl)oxy)4Hchromen4one
3(34DIHYDRO2H15BENZODIOXEPIN7YL)6ETHYL2METHYL7((4METHYLPHENYL)METHOXY)CHROMEN4ONE
3(34dihydro2Hbenzo(b)(14)dioxepin7yl)6ethyl2methyl7((4methylbenzyl)oxy)4Hchromen4one
610761303
CCC1=C(C=C2C(=C1)C(=O)C(=C(O2)C)C3=CC4=C(C=C3)OCCCO4)OCC5=CC=C(C=C5)C
InChI=1SC29H28O5c1421142326(1625(21)3317208618(2)7920)3419(3)28(29(23)30)2210112427(1522)32135123124h6111416H45121317H213H3
MFCD03850970
ZINC000002147827
ZINC02147827
ZINC2147827
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