Vitas-M small molecule compound
methyl N-[(4E)-6-(4,6-dimethoxy-7-methyl-3-oxo-1,3-dihydro-2-benzofuran-5-yl)-4-methylhex-4-enoyl]-L-leucinate
Catalog ID
STL544064
SMILES COC(=O)[C@@H](NC(=O)CC/C(=C/Cc1c(OC)c(C)c2c(c1OC)C(=O)OC2)/C)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 C25H35NO7 MW 461.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H35NO7/c1-14(2)12-19(24(28)32-7)26-20(27)11-9-15(3)8-10-17-22(30-5)16(4)18-13-33-25(29)21(18)23(17)31-6/h8,14,19H,9-13H2,1-7H3,(H,26,27)/b15-8+/t19-/m0/s1InChIKey
WRIAWOBSNUUJRD-UCSSQIFYSA-NSynonyms
(SE)methyl2(6(46dimethoxy7methyl3oxo13dihydroisobenzofuran5yl)4methylhex4enamido)4methylpentanoate
91636663
COC(=O)(C@@H)(NC(=O)CCC(=CCc1c(OC)c(C)c2c(c1OC)C(=O)OC2)C)CC(C)C
InChI=1SC25H35NO7c114(2)1219(24(28)327)2620(27)11915(3)8101722(305)16(4)18133325(29)21(18)23(17)316h81419H913H217H3(H2627)b158+t19m0s1
methyl(2~(S))2(((~(E))6(46dimethoxy7methyl3oxo1~(H)2benzofuran5yl)4methylhex4enoyl)amino)4methylpentanoate
methylN((4E)6(46dimethoxy7methyl3oxo13dihydro2benzofuran5yl)4methylhex4enoyl)Lleucinate
ZINC000217625444
ZINC217625444
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