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D3;N-[1,2-DIMETHOXY-3-HYDROXY-10-METHYLSULPHANYL-9-OXO-5,6,7,9-TETRAHYDRO-BENZO-[A]-HEPTALEN-7-YL]-ACETAMIDE;3-O-DEMETHYLTHIOCOLCHICINE

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D3;N-[1,2-DIMETHOXY-3-HYDROXY-10-METHYLSULPHANYL-9-OXO-5,6,7,9-TETRAHYDRO-BENZO-[A]-HEPTALEN-7-YL]-ACETAMIDE;3-O-DEMETHYLTHIOCOLCHICINE
SpectraBase Compound ID 7WfFs3X9fj0
InChI InChI=1S/C21H23NO5S/c1-11(23)22-15-7-5-12-9-17(25)20(26-2)21(27-3)19(12)13-6-8-18(28-4)16(24)10-14(13)15/h6,8-10,15,25H,5,7H2,1-4H3,(H,22,23)
InChIKey PKYOHQGXPPVIGD-UHFFFAOYSA-N
Mol Weight 401.48 g/mol
Molecular Formula C21H23NO5S
Exact Mass 401.129694 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2UK9tBfGpgb
Name D3;N-[1,2-DIMETHOXY-3-HYDROXY-10-METHYLSULPHANYL-9-OXO-5,6,7,9-TETRAHYDRO-BENZO-[A]-HEPTALEN-7-YL]-ACETAMIDE;3-O-DEMETHYLTHIOCOLCHICINE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H23NO5S
InChI InChI=1S/C21H23NO5S/c1-11(23)22-15-7-5-12-9-17(25)20(26-2)21(27-3)19(12)13-6-8-18(28-4)16(24)10-14(13)15/h6,8-10,15,25H,5,7H2,1-4H3,(H,22,23)
InChIKey PKYOHQGXPPVIGD-UHFFFAOYSA-N
Literature Reference Author E.DELGROSSO,S.APRILE,G.GROSA
Literature Reference Citation J.PHARM.BIOM.ANAL.,61,215(2012)
Literature Reference DOI 10.1016/j.jpba.2011.12.008
Molecular Weight 401.477 g/mol
Solvent DMSO-D6
Source File Reference UWMZ44041