Vitas-M small molecule compound

methyl 3-[7-hydroxy-3-(4-hydroxyphenyl)-4-oxo-4H-chromen-8-yl]-3-(6-methoxy-4-oxo-4H-chromen-3-yl)propanoate

Catalog ID
STL540070
SMILES COC(=O)CC(c1coc2c(c1=O)cc(cc2)OC)c1c(O)ccc2c1occ(c2=O)c1ccc(cc1)O

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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 C29H22O9 MW 514.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H22O9/c1-35-17-7-10-24-20(11-17)28(34)22(14-37-24)19(12-25(32)36-2)26-23(31)9-8-18-27(33)21(13-38-29(18)26)15-3-5-16(30)6-4-15/h3-11,13-14,19,30-31H,12H2,1-2H3
InChIKey
FIGSHGPAGQMAOJ-UHFFFAOYSA-N
Synonyms
1574470-65-7
1574470657
71826855
InChI=1SC29H22O9c135177102420(1117)28(34)22(143724)19(1225(32)362)2623(31)981827(33)21(133829(18)26)153516(30)6415h3111314193031H12H212H3
methyl3(7hydroxy3(4hydroxyphenyl)4oxo4Hchromen8yl)3(6methoxy4oxo4Hchromen3yl)propanoate
methyl3(7hydroxy3(4hydroxyphenyl)4oxochromen8yl)3(6methoxy4oxochromen3yl)propanoate
MFCD28051031
ZINC000096114540
ZINC000096114541

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Available files

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