Vitas-M small molecule compound

methyl 3-(4-bromophenyl)-3-[7-hydroxy-3-(4-hydroxyphenyl)-4-oxo-4H-chromen-8-yl]propanoate

Catalog ID
STL540494
SMILES COC(=O)CC(c1c(O)ccc2c1occ(c2=O)c1ccc(cc1)O)c1ccc(cc1)Br

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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 C25H19BrO6 MW 495.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H19BrO6/c1-31-22(29)12-19(14-2-6-16(26)7-3-14)23-21(28)11-10-18-24(30)20(13-32-25(18)23)15-4-8-17(27)9-5-15/h2-11,13,19,27-28H,12H2,1H3
InChIKey
KRACXGHKYZFEMC-UHFFFAOYSA-N
Synonyms
1574477-84-1
1574477841
71826279
InChI=1SC25H19BrO6c13122(29)1219(142616(26)7314)2321(28)11101824(30)20(133225(18)23)154817(27)9515h21113192728H12H21H3
methyl3(4bromophenyl)3(7hydroxy3(4hydroxyphenyl)4oxo4Hchromen8yl)propanoate
methyl3(4bromophenyl)3(7hydroxy3(4hydroxyphenyl)4oxochromen8yl)propanoate
MFCD28051492
ZINC000096115395
ZINC000096115396

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Available files

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