Vitas-M small molecule compound
N-({[(2E)-2-(2,4-dimethoxybenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl]oxy}acetyl)-L-leucine
Catalog ID
STL530090
SMILES COc1cc(OC)ccc1/C=C\1/Oc2c(C1=O)ccc(c2)OCC(=O)N[C@H](C(=O)O)CC(C)C
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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 C25H27NO8 MW 469.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27NO8/c1-14(2)9-19(25(29)30)26-23(27)13-33-17-7-8-18-21(12-17)34-22(24(18)28)10-15-5-6-16(31-3)11-20(15)32-4/h5-8,10-12,14,19H,9,13H2,1-4H3,(H,26,27)(H,29,30)/b22-10+/t19-/m0/s1InChIKey
MBIFWXUTZPFGMX-IBUCALKDSA-NSynonyms
956775-91-0(2~(S))2((2(((2~(E))2((24dimethoxyphenyl)methylidene)3oxo1benzofuran6yl)oxy)acetyl)amino)4methylpentanoicacid
(SE)2(2((2(24dimethoxybenzylidene)3oxo23dihydrobenzofuran6yl)oxy)acetamido)4methylpentanoicacid
16406048
956775910
COc1cc(OC)ccc1C=C1Oc2c(C1=O)ccc(c2)OCC(=O)N(C@H)(C(=O)O)CC(C)C
InChI=1SC25H27NO8c114(2)919(25(29)30)2623(27)133317781821(1217)3422(24(18)28)10155616(313)1120(15)324h5810121419H913H214H3(H2627)(H2930)b2210+t19m0s1
N((((2E)2(24dimethoxybenzylidene)3oxo23dihydro1benzofuran6yl)oxy)acetyl)Lleucine
ZINC000008876297
ZINC8876297
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