Vitas-M small molecule compound
methyl 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-4-oxo-4H-chromen-8-yl]propanoate
Catalog ID
STL541623
SMILES COC(=O)CC(c1c(O)cc(c2c1oc(c1ccc(c(c1)O)O)c(c2=O)O)O)c1ccc2c(c1)OCCO2
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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 C27H22O11 MW 522.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22O11/c1-35-21(32)10-14(12-3-5-19-20(9-12)37-7-6-36-19)22-17(30)11-18(31)23-24(33)25(34)26(38-27(22)23)13-2-4-15(28)16(29)8-13/h2-5,8-9,11,14,28-31,34H,6-7,10H2,1H3InChIKey
SXQQXORWDXBFEJ-UHFFFAOYSA-NSynonyms
1574411-29-21574411292
71826247
InChI=1SC27H22O11c13521(32)1014(12351920(912)37763619)2217(30)1118(31)2324(33)25(34)26(3827(22)23)132415(28)16(29)813h25891114283134H6710H21H3
methyl3(23dihydro14benzodioxin6yl)3(2(34dihydroxyphenyl)357trihydroxy4oxo4Hchromen8yl)propanoate
methyl3(23dihydro14benzodioxin6yl)3(2(34dihydroxyphenyl)357trihydroxy4oxochromen8yl)propanoate
METHYL3(23DIHYDROBENZO(B)(14)DIOXIN6YL)3(2(34DIHYDROXYPHENYL)357TRIHYDROXY4OXO4HCHROMEN8YL)PROPANOATE
MFCD28051514
ZINC000097972037
ZINC000097972038
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