Vitas-M small molecule compound
ethyl 4-[(4E)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1,3-dihydro-2-benzofuran-5-yl)-4-methylhex-4-enoyl]piperazine-1-carboxylate
Catalog ID
STL476178
SMILES CCOC(=O)N1CCN(CC1)C(=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 C24H32N2O7 MW 460.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H32N2O7/c1-5-32-24(30)26-12-10-25(11-13-26)19(27)9-7-15(2)6-8-17-21(28)20-18(14-33-23(20)29)16(3)22(17)31-4/h6,28H,5,7-14H2,1-4H3/b15-6+InChIKey
TYBAIZOSECTGOD-GIDUJCDVSA-NSynonyms
1630907-75-3(E)ethyl4(6(4hydroxy6methoxy7methyl3oxo13dihydroisobenzofuran5yl)4methylhex4enoyl)piperazine1carboxylate
1630907753
CCOC(=O)N1CCN(CC1)C(=O)CCC(=CCc1c(OC)c(C)c2c(c1O)C(=O)OC2)C
CCOC(=O)N1CCN(CC1)C(=O)CCC(=CCC2=C(C3=C(COC3=O)C(=C2OC)C)O)C
ethyl4((4E)6(4hydroxy6methoxy7methyl3oxo13dihydro2benzofuran5yl)4methylhex4enoyl)piperazine1carboxylate
ethyl4((E)6(4hydroxy6methoxy7methyl3oxo1H2benzofuran5yl)4methylhex4enoyl)piperazine1carboxylate
InChI=1SC24H32N2O7c153224(30)26121025(111326)19(27)9715(2)681721(28)2018(143323(20)29)16(3)22(17)314h628H5714H214H3b156+
MFCD28349798
ZINC000217846754
ZINC217846754
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