Vitas-M small molecule compound
(2R)-[({[(2Z)-2-(1,3-benzodioxol-5-ylmethylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl]oxy}acetyl)amino](phenyl)ethanoic acid
Catalog ID
STL531595
SMILES O=C(N[C@H](c1ccccc1)C(=O)O)COc1ccc2c(c1)O/C(=C\c1ccc3c(c1)OCO3)/C2=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 C26H19NO8 MW 473.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H19NO8/c28-23(27-24(26(30)31)16-4-2-1-3-5-16)13-32-17-7-8-18-20(12-17)35-22(25(18)29)11-15-6-9-19-21(10-15)34-14-33-19/h1-12,24H,13-14H2,(H,27,28)(H,30,31)/b22-11-/t24-/m1/s1InChIKey
NXWRDFUHUJTLPM-QJWUKVPRSA-NSynonyms
956972-57-9(2~(R))2((2(((2~(Z))2(13benzodioxol5ylmethylidene)3oxo1benzofuran6yl)oxy)acetyl)amino)2phenylaceticacid
(2R)(((((2Z)2(13benzodioxol5ylmethylidene)3oxo23dihydro1benzofuran6yl)oxy)acetyl)amino)(phenyl)ethanoicacid
(RZ)2(2((2(benzo(d)(13)dioxol5ylmethylene)3oxo23dihydrobenzofuran6yl)oxy)acetamido)2phenylaceticacid
16404816
956972579
InChI=1SC26H19NO8c2823(2724(26(30)31)164213516)133217781820(1217)3522(25(18)29)1115691921(1015)34143319h11224H1314H2(H2728)(H3031)b2211t24m1s1
O=C(N(C@H)(c1ccccc1)C(=O)O)COc1ccc2c(c1)OC(=Cc1ccc3c(c1)OCO3)C2=O
ZINC000012885168
ZINC12885168
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