Vitas-M small molecule compound
3-(5-{1-[3-hydroxy-6-(methoxymethyl)-4-oxo-4H-pyran-2-yl]-3-methoxy-3-oxopropyl}furan-2-yl)benzoic acid
Catalog ID
STL539796
SMILES COCc1cc(=O)c(c(o1)C(c1ccc(o1)c1cccc(c1)C(=O)O)CC(=O)OC)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 C22H20O9 MW 428.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20O9/c1-28-11-14-9-16(23)20(25)21(30-14)15(10-19(24)29-2)18-7-6-17(31-18)12-4-3-5-13(8-12)22(26)27/h3-9,15,25H,10-11H2,1-2H3,(H,26,27)InChIKey
PJQCYQQRUCQZTA-UHFFFAOYSA-NSynonyms
1574399-81-71574399817
3(5(1(3hydroxy6(methoxymethyl)4oxo4Hpyran2yl)3methoxy3oxopropyl)furan2yl)benzoicacid
3(5(1(3hydroxy6(methoxymethyl)4oxopyran2yl)3methoxy3oxopropyl)furan2yl)benzoicacid
71825850
InChI=1SC22H20O9c1281114916(23)20(25)21(3014)15(1019(24)292)187617(3118)1243513(812)22(26)27h391525H1011H212H3(H2627)
MFCD28051832
ZINC000096116050
ZINC000096116051
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