Vitas-M small molecule compound

3,3'-[(2,3-dimethoxyphenyl)methanediyl]bis(4-hydroxy-2H-chromen-2-one)

Catalog ID
STK825528
SMILES COc1c(OC)cccc1C(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 C27H20O8 MW 472.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H20O8/c1-32-19-13-7-10-16(25(19)33-2)20(21-23(28)14-8-3-5-11-17(14)34-26(21)30)22-24(29)15-9-4-6-12-18(15)35-27(22)31/h3-13,20,28-29H,1-2H3
InChIKey
TWRZXJUDMNMATE-UHFFFAOYSA-N
Synonyms
115604-40-5
115604405
3((23DIMETHOXYPHENYL)(2HYDROXY4OXOCHROMEN3YL)METHYL)2HYDROXYCHROMEN4ONE
3((23DIMETHOXYPHENYL)(4HYDROXY2OXO2HCHROMEN3YL)METHYL)4HYDROXY2HCHROMEN2ONE
3((23dimethoxyphenyl)(4hydroxy2oxochromen3yl)methyl)4hydroxychromen2one
33((23dimethoxyphenyl)methanediyl)bis(4hydroxy2Hchromen2one)
33((23dimethoxyphenyl)methylene)bis(4hydroxy2Hchromen2one)
COC1=CC=CC(=C1OC)C(C2=C(C3=CC=CC=C3OC2=O)O)C4=C(C5=CC=CC=C5OC4=O)O
InChI=1SC27H20O8c132191371016(25(19)332)20(2123(28)148351117(14)3426(21)30)2224(29)159461218(15)3527(22)31h313202829H12H3
MFCD01543801
ZINC000009972876
ZINC9972876

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Available files

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