Vitas-M small molecule compound

N~2~-({[(2Z)-3-oxo-2-(2,3,4-trimethoxybenzylidene)-2,3-dihydro-1-benzofuran-6-yl]oxy}acetyl)-D-asparagine

Catalog ID
STL531578
SMILES COc1c(ccc(c1OC)OC)/C=C/1\Oc2c(C1=O)ccc(c2)OCC(=O)N[C@@H](C(=O)O)CC(=O)N

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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 C24H24N2O10 MW 500.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H24N2O10/c1-32-16-7-4-12(22(33-2)23(16)34-3)8-18-21(29)14-6-5-13(9-17(14)36-18)35-11-20(28)26-15(24(30)31)10-19(25)27/h4-9,15H,10-11H2,1-3H3,(H2,25,27)(H,26,28)(H,30,31)/b18-8-/t15-/m1/s1
InChIKey
UEOWMRCJIMMKLF-OADJVDCOSA-N
Synonyms
957020-78-9
(2~(R))4amino4oxo2((2(((2~(Z))3oxo2((234trimethoxyphenyl)methylidene)1benzofuran6yl)oxy)acetyl)amino)butanoicacid
(RZ)4AMINO4OXO2(2((3OXO2(234TRIMETHOXYBENZYLIDENE)23DIHYDROBENZOFURAN6YL)OXY)ACETAMIDO)BUTANOICACID
16404368
957020789
COc1c(ccc(c1OC)OC)C=C1Oc2c(C1=O)ccc(c2)OCC(=O)N(C@@H)(C(=O)O)CC(=O)N
InChI=1SC24H24N2O10c132167412(22(332)23(16)343)81821(29)146513(917(14)3618)351120(28)2615(24(30)31)1019(25)27h4915H1011H213H3(H22527)(H2628)(H3031)b188t15m1s1
N~2~((((2Z)3oxo2(234trimethoxybenzylidene)23dihydro1benzofuran6yl)oxy)acetyl)Dasparagine
N2((((2Z)3OXO2(234TRIMETHOXYBENZYLIDENE)23DIHYDRO1BENZOFURAN6YL)OXY)ACETYL)DASPARAGINE
ZINC000012883621
ZINC12883621

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Available files

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