Vitas-M small molecule compound

3,3'-[(4-hydroxy-3,5-dimethoxyphenyl)methanediyl]bis(4-hydroxy-2H-chromen-2-one)

Catalog ID
STK386309
SMILES COc1cc(cc(c1O)OC)C(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 C27H20O9 MW 488.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H20O9/c1-33-18-11-13(12-19(34-2)25(18)30)20(21-23(28)14-7-3-5-9-16(14)35-26(21)31)22-24(29)15-8-4-6-10-17(15)36-27(22)32/h3-12,20,28-30H,1-2H3
InChIKey
HXRVGLDRJRNCBG-UHFFFAOYSA-N
Synonyms

2HYDROXY3((4HYDROXY35DIMETHOXYPHENYL)(2HYDROXY4OXOCHROMEN3YL)METHYL)CHROMEN4ONE
33((4HYDROXY35DIMETHOXYPHENYL)METHANEDIYL)BIS(4HYDROXY2HCHROMEN2ONE)
33((4HYDROXY35DIMETHOXYPHENYL)METHYLENE)BIS(4HYDROXY2HCHROMEN2ONE)
4HYDROXY3((4HYDROXY35DIMETHOXYPHENYL)(4HYDROXY2OXOCHROMEN3YL)METHYL)CHROMEN2ONE
COC1=CC(=CC(=C1O)OC)C(C2=C(C3=CC=CC=C3OC2=O)O)C4=C(C5=CC=CC=C5OC4=O)O
InChI=1SC27H20O9c133181113(1219(342)25(18)30)20(2123(28)14735916(14)3526(21)31)2224(29)158461017(15)3627(22)32h312202830H12H3
MFCD05661478
ZINC000005618523
ZINC5618523

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Available files

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