Vitas-M small molecule compound
(2S,3S)-3-hydroxy-2-(2-(((E)-3-oxo-2-(3,4,5-trimethoxybenzylidene)-2,3-dihydrobenzofuran-6-yl)oxy)acetamido)butanoic acid
Catalog ID
STL533154
SMILES COc1cc(/C=C\2/Oc3c(C2=O)ccc(c3)OCC(=O)N[C@H](C(=O)O)C(O)C)cc(c1OC)OC
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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 C24H25NO10 MW 487.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25NO10/c1-12(26)21(24(29)30)25-20(27)11-34-14-5-6-15-16(10-14)35-17(22(15)28)7-13-8-18(31-2)23(33-4)19(9-13)32-3/h5-10,12,21,26H,11H2,1-4H3,(H,25,27)(H,29,30)/b17-7+/t12?,21-/m0/s1InChIKey
DQLYNGNINHYVRH-DISXJSIISA-NSynonyms
956998-41-7(2~(S))3hydroxy2((2(((2~(E))3oxo2((345trimethoxyphenyl)methylidene)1benzofuran6yl)oxy)acetyl)amino)butanoicacid
(2S3S)3hydroxy2(2(((E)3oxo2(345trimethoxybenzylidene)23dihydrobenzofuran6yl)oxy)acetamido)butanoicacid
16406500
956998417
COc1cc(C=C2Oc3c(C2=O)ccc(c3)OCC(=O)N(C@H)(C(=O)O)C(O)C)cc(c1OC)OC
InChI=1SC24H25NO10c112(26)21(24(29)30)2520(27)113414561516(1014)3517(22(15)28)713818(312)23(334)19(913)323h510122126H11H214H3(H2527)(H2930)b177+t12?21m0s1
MFCD07637801
ZINC000008876718
ZINC000012889976
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