Vitas-M small molecule compound

ethyl 2-({5-[bis(4-hydroxy-2-oxo-2H-chromen-3-yl)methyl]-2-methoxybenzyl}oxy)benzoate

Catalog ID
STK627436
SMILES CCOC(=O)c1ccccc1OCc1cc(ccc1OC)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 C36H28O10 MW 620.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H28O10/c1-3-43-34(39)24-12-6-7-13-26(24)44-19-21-18-20(16-17-25(21)42-2)29(30-32(37)22-10-4-8-14-27(22)45-35(30)40)31-33(38)23-11-5-9-15-28(23)46-36(31)41/h4-18,29,37-38H,3,19H2,1-2H3
InChIKey
QAAXIFGJTFWJBF-UHFFFAOYSA-N
Synonyms
370585-51-6
370585516
CCOC(=O)C1=CC=CC=C1OCC2=C(C=CC(=C2)C(C3=C(C4=CC=CC=C4OC3=O)O)C5=C(C6=CC=CC=C6OC5=O)O)OC
ETHYL2((5(BIS(2HYDROXY4OXOCHROMEN3YL)METHYL)2METHOXYPHENYL)METHOXY)BENZOATE
ethyl2((5(bis(4hydroxy2oxo2Hchromen3yl)methyl)2methoxybenzyl)oxy)benzoate
ethyl2((5(bis(4hydroxy2oxochromen3yl)methyl)2methoxyphenyl)methoxy)benzoate
InChI=1SC36H28O10c134334(39)2412671326(24)4419211820(161725(21)422)29(3032(37)2210481427(22)4535(30)40)3133(38)2311591528(23)4636(31)41h418293738H319H212H3
MFCD03006427
ZINC000097956207
ZINC97956207

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Available files

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