Vitas-M small molecule compound
(2S)-[({[(2E)-2-(2,4-dimethoxybenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl]oxy}acetyl)amino](phenyl)ethanoic acid
Catalog ID
STK583752
SMILES COc1cc(OC)ccc1/C=C\1/Oc2c(C1=O)ccc(c2)OCC(=O)N[C@@H](c1ccccc1)C(=O)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 C27H23NO8 MW 489.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23NO8/c1-33-18-9-8-17(21(13-18)34-2)12-23-26(30)20-11-10-19(14-22(20)36-23)35-15-24(29)28-25(27(31)32)16-6-4-3-5-7-16/h3-14,25H,15H2,1-2H3,(H,28,29)(H,31,32)/b23-12+/t25-/m0/s1InChIKey
FVTFSEDTXPQTHO-WLPTYJMBSA-NSynonyms
1173663-24-5(2S)(((((2E)2(24dimethoxybenzylidene)3oxo23dihydro1benzofuran6yl)oxy)acetyl)amino)(phenyl)ethanoicacid
(2S)2((2(((2E)2((24dimethoxyphenyl)methylidene)3oxo1benzofuran6yl)oxy)acetyl)amino)2phenylaceticacid
(RZ)2(2((2(24dimethoxybenzylidene)3oxo23dihydrobenzofuran6yl)oxy)acetamido)2phenylaceticacid
1173663245
COC1=CC(=C(C=C1)C=C2C(=O)C3=C(O2)C=C(C=C3)OCC(=O)NC(C4=CC=CC=C4)C(=O)O)OC
COc1cc(OC)ccc1C=C1Oc2c(C1=O)ccc(c2)OCC(=O)N(C@@H)(c1ccccc1)C(=O)O
COc1cc(OC)ccc1C=C1Oc2c(C1=O)ccc(c2)OCC(=O)N(C@H)(c1ccccc1)C(=O)O
InChI=1SC27H23NO8c133189817(21(1318)342)122326(30)20111019(1422(20)3623)351524(29)2825(27(31)32)166435716h31425H15H212H3(H2829)(H3132)b2312+t25m0s1
MFCD07639108
ZINC000009128702
ZINC9128702
Check stock
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Check stock on Vitas-MAvailable files
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