5-N-ACETYLCYSTEINYL-[6]-SHOGAOL

SpectraBase Compound ID	AWROZcbBDOY
InChI	InChI=1S/C22H33NO6S/c1-4-5-6-7-18(30-14-19(22(27)28)23-15(2)24)13-17(25)10-8-16-9-11-20(26)21(12-16)29-3/h9,11-12,18-19,26H,4-8,10,13-14H2,1-3H3,(H,23,24)(H,27,28)/t18?,19-/m0/s1
InChIKey	WATGOSHZDGAQHA-GGYWPGCISA-N Google Search
Mol Weight	439.6 g/mol
Molecular Formula	C22H33NO6S
Exact Mass	439.202859 g/mol

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SpectraBase Spectrum ID	30BPrC5KZMN
Name	5-N-ACETYLCYSTEINYL-[6]-SHOGAOL
Copyright	Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula	C22H33NO6S
InChI	InChI=1S/C22H33NO6S/c1-4-5-6-7-18(30-14-19(22(27)28)23-15(2)24)13-17(25)10-8-16-9-11-20(26)21(12-16)29-3/h9,11-12,18-19,26H,4-8,10,13-14H2,1-3H3,(H,23,24)(H,27,28)/t18?,19-/m0/s1
InChIKey	WATGOSHZDGAQHA-GGYWPGCISA-N
Literature Reference Author	H.CHEN,L.LV,D.SOROKA,R.F.WARIN,T.A.PARKS,Y.HU,Y.ZHU,X.CHEN,S .SANG
Literature Reference Citation	DRUG.MET.DISP.,40,742(2012)
Literature Reference DOI	10.1124/dmd.111.043331
Molecular Weight	439.567 g/mol
Source File Reference	UWLU75285