Vitas-M small molecule compound

3,3'-butane-1,1-diylbis(4-hydroxy-2H-chromen-2-one)

Catalog ID
STK364544
SMILES CCCC(c1c(=O)oc2c(c1O)cccc2)c1c(=O)oc2c(c1O)cccc2

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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 C22H18O6 MW 378.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18O6/c1-2-7-14(17-19(23)12-8-3-5-10-15(12)27-21(17)25)18-20(24)13-9-4-6-11-16(13)28-22(18)26/h3-6,8-11,14,23-24H,2,7H2,1H3
InChIKey
WDMKQGDXHVGITQ-UHFFFAOYSA-N
Synonyms
1821-18-7
1821187
2H1BENZOPYRAN2ONE33BUTYLIDENEBIS(4HYDROXY
2HYDROXY3(1(2HYDROXY4OXOCHROMEN3YL)BUTYL)CHROMEN4ONE
33BUTANE11DIYLBIS(2HYDROXY4HCHROMEN4ONE)
33BUTANE11DIYLBIS(4HYDROXY2HCHROMEN2ONE)
33BUTYLIDENEBIS(4HYDROXY2H1BENZOPYRAN2ONE
33BUTYLIDENEBIS(4HYDROXYCOUMARIN)
4HYDROXY3((4HYDROXY2OXOCHROMEN3YL)BUTYL)CHROMEN2ONE
4hydroxy3(1(4hydroxy2oxochromen3yl)butyl)chromen2one
CCCC(C1=C(C2=CC=CC=C2OC1=O)O)C3=C(C4=CC=CC=C4OC3=O)O
InChI=1SC22H18O6c12714(1719(23)128351015(12)2721(17)25)1820(24)139461116(13)2822(18)26h36811142324H27H21H3
MFCD05661650
SYMMETRICDICOUMAROLANALOGUE15
ZINC000005819733
ZINC5819733

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.