Vitas-M small molecule compound
methyl N-[(4E)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1,3-dihydro-2-benzofuran-5-yl)-4-methylhex-4-enoyl]glycinate
Catalog ID
STL520288
SMILES COC(=O)CNC(=O)CC/C(=C/Cc1c(OC)c(C)c2c(c1O)C(=O)OC2)/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 C20H25NO7 MW 391.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25NO7/c1-11(6-8-15(22)21-9-16(23)26-3)5-7-13-18(24)17-14(10-28-20(17)25)12(2)19(13)27-4/h5,24H,6-10H2,1-4H3,(H,21,22)/b11-5+InChIKey
KQRHXJLBAGJUFU-VZUCSPMQSA-NSynonyms
1532533-47-3(E)METHYL2(6(4HYDROXY6METHOXY7METHYL3OXO13DIHYDROISOBENZOFURAN5YL)4METHYLHEX4ENAMIDO)ACETATE
1532533473
52905544
COC(=O)CNC(=O)CCC(=CCc1c(OC)c(C)c2c(c1O)C(=O)OC2)C
InChI=1SC20H25NO7c111(6815(22)21916(23)263)571318(24)1714(102820(17)25)12(2)19(13)274h524H610H214H3(H2122)b115+
methyl2(((~(E))6(4hydroxy6methoxy7methyl3oxo1~(H)2benzofuran5yl)4methylhex4enoyl)amino)acetate
methylN((4E)6(4hydroxy6methoxy7methyl3oxo13dihydro2benzofuran5yl)4methylhex4enoyl)glycinate
MFCD18791128
ZINC000062001757
ZINC62001757
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