1-ADAMANTYL-3-[2-(7-METHOXY-1,2,3,4-TETRAHYDROACRIDIN-9-YL-AMINO)-HEXYL]-THIOUREA-2,3-DIHYDROXYSUCCINATE

SpectraBase Compound ID	5nyBsj6wyf2
InChI	InChI=1S/C31H44N4OS.C4H6O6/c1-36-24-10-11-28-26(17-24)29(25-8-4-5-9-27(25)34-28)32-12-6-2-3-7-13-33-30(37)35-31-18-21-14-22(19-31)16-23(15-21)20-31;5-1(3(7)8)2(6)4(9)10/h10-11,17,21-23H,2-9,12-16,18-20H2,1H3,(H,32,34)(H2,33,35,37);1-2,5-6H,(H,7,8)(H,9,10)/t21-,22+,23-,31-;
InChIKey	GEUUTTZJKDKWIZ-SWIBNYDSSA-N Google Search
Mol Weight	670.9 g/mol
Molecular Formula	C35H50N4O7S
Exact Mass	670.340021 g/mol

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SpectraBase Spectrum ID	CkAjTpX9hmD
Name	1-ADAMANTYL-3-[2-(7-METHOXY-1,2,3,4-TETRAHYDROACRIDIN-9-YL-AMINO)-HEXYL]-THIOUREA-2,3-DIHYDROXYSUCCINATE
Compound Number	15
Copyright	Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula	C35H50N4O7S
InChI	InChI=1S/C31H44N4OS.C4H6O6/c1-36-24-10-11-28-26(17-24)29(25-8-4-5-9-27(25)34-28)32-12-6-2-3-7-13-33-30(37)35-31-18-21-14-22(19-31)16-23(15-21)20-31;5-1(3(7)8)2(6)4(9)10/h10-11,17,21-23H,2-9,12-16,18-20H2,1H3,(H,32,34)(H2,33,35,37);1-2,5-6H,(H,7,8)(H,9,10)/t21-,22+,23-,31-;
InChIKey	GEUUTTZJKDKWIZ-SWIBNYDSSA-N
Literature Reference Author	K.SPILOVSKA,J.KORABECNY,J.KRAL,A.HOROVA,K.MUSILEK,O.SOUKUP,L .DRTINOVA,Z.GAZOVA,
Literature Reference Citation	MOLECULES,18,2397(2013)
Literature Reference DOI	10.3390/molecules18022397
Molecular Weight	670.865 g/mol
Solvent	DMSO-D6
Source File Reference	UWBT8827