Vitas-M small molecule compound
4-[5-(5-methyl-2,8-dioxo-3,4,8,9,10,11-hexahydro-2H-cyclopenta[c]pyrano[2,3-f]chromen-4-yl)furan-2-yl]benzoic acid
Catalog ID
STL547914
SMILES O=C1CC(c2ccc(o2)c2ccc(cc2)C(=O)O)c2c(O1)c1c(cc2C)oc(=O)c2c1CCC2
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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 C27H20O7 MW 456.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H20O7/c1-13-11-21-24(16-3-2-4-17(16)27(31)33-21)25-23(13)18(12-22(28)34-25)20-10-9-19(32-20)14-5-7-15(8-6-14)26(29)30/h5-11,18H,2-4,12H2,1H3,(H,29,30)InChIKey
FHTDSUOIESOUSH-UHFFFAOYSA-NSynonyms
121541393
4(5(5methyl28dioxo34891011hexahydro2Hcyclopenta(c)pyrano(23f)chromen4yl)furan2yl)benzoicacid
4(5(8methyl412dioxo311dioxatetracyclo(8700^(27)0^(1317))heptadeca1(10)2(7)813(17)tetraen6yl)furan2yl)benzoicacid
InChI=1SC27H20O7c113112124(1632417(16)27(31)3321)2523(13)18(1222(28)3425)2010919(3220)145715(8614)26(29)30h51118H2412H21H3(H2930)
MFCD30344171
ZINC000263585118
ZINC000263585119
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