Vitas-M small molecule compound

N-({[(2Z)-2-(3-methoxybenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl]oxy}acetyl)-D-phenylalanine

Catalog ID
STL537500
SMILES COc1cccc(c1)/C=C/1\Oc2c(C1=O)ccc(c2)OCC(=O)N[C@@H](C(=O)O)Cc1ccccc1

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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 C27H23NO7 MW 473.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23NO7/c1-33-19-9-5-8-18(12-19)14-24-26(30)21-11-10-20(15-23(21)35-24)34-16-25(29)28-22(27(31)32)13-17-6-3-2-4-7-17/h2-12,14-15,22H,13,16H2,1H3,(H,28,29)(H,31,32)/b24-14-/t22-/m1/s1
InChIKey
OYHATVDJFFIYQC-UTKDAVAPSA-N
Synonyms
956956-62-0
(2~(R))2((2(((2~(Z))2((3methoxyphenyl)methylidene)3oxo1benzofuran6yl)oxy)acetyl)amino)3phenylpropanoicacid
(RZ)2(2((2(3METHOXYBENZYLIDENE)3OXO23DIHYDROBENZOFURAN6YL)OXY)ACETAMIDO)3PHENYLPROPANOICACID
16404308
956956620
COc1cccc(c1)C=C1Oc2c(C1=O)ccc(c2)OCC(=O)N(C@@H)(C(=O)O)Cc1ccccc1
InChI=1SC27H23NO7c1331995818(1219)142426(30)21111020(1523(21)3524)341625(29)2822(27(31)32)13176324717h212141522H1316H21H3(H2829)(H3132)b2414t22m1s1
N((((2Z)2(3methoxybenzylidene)3oxo23dihydro1benzofuran6yl)oxy)acetyl)Dphenylalanine
ZINC000008790463
ZINC8790463

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.