Vitas-M small molecule compound
methyl 3-[7-hydroxy-3-(4-hydroxyphenyl)-4-oxo-4H-chromen-8-yl]-3-(7-methoxy-1,3-benzodioxol-5-yl)propanoate
Catalog ID
STL540976
SMILES COC(=O)CC(c1c(O)ccc2c1occ(c2=O)c1ccc(cc1)O)c1cc(OC)c2c(c1)OCO2
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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 C27H22O9 MW 490.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22O9/c1-32-21-9-15(10-22-27(21)36-13-35-22)18(11-23(30)33-2)24-20(29)8-7-17-25(31)19(12-34-26(17)24)14-3-5-16(28)6-4-14/h3-10,12,18,28-29H,11,13H2,1-2H3InChIKey
OCTAFJJWLKOAGP-UHFFFAOYSA-NSynonyms
1574514-03-61574514036
71825936
InChI=1SC27H22O9c13221915(102227(21)36133522)18(1123(30)332)2420(29)871725(31)19(123426(17)24)143516(28)6414h31012182829H1113H212H3
methyl3(7hydroxy3(4hydroxyphenyl)4oxo4Hchromen8yl)3(7methoxy13benzodioxol5yl)propanoate
METHYL3(7HYDROXY3(4HYDROXYPHENYL)4OXO4HCHROMEN8YL)3(7METHOXYBENZO(D)(13)DIOXOL5YL)PROPANOATE
methyl3(7hydroxy3(4hydroxyphenyl)4oxochromen8yl)3(7methoxy13benzodioxol5yl)propanoate
MFCD28051757
ZINC000096115921
ZINC000096115922
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