3-(1-tert-butoxycarbonylindol-3-yl)-2-[[2-[2-[2-[[2-[(5-dimethylamino-1-naphthyl)sulfonylamino]-4-methyl-pentanoyl]amino]propanoylamino]propanoylamino]-4-methyl-pentanoyl]amino]propionic acid

SpectraBase Compound ID	Fx90lWK0OBm
InChI	InChI=1S/C46H63N7O10S/c1-26(2)22-34(42(56)50-36(44(58)59)24-30-25-53(45(60)63-46(7,8)9)38-19-13-12-16-31(30)38)49-41(55)29(6)47-40(54)28(5)48-43(57)35(23-27(3)4)51-64(61,62)39-21-15-17-32-33(39)18-14-20-37(32)52(10)11/h12-21,25-29,34-36,51H,22-24H2,1-11H3,(H,47,54)(H,48,57)(H,49,55)(H,50,56)(H,58,59)
InChIKey	WGQYODWRYLEQEU-UHFFFAOYSA-N Google Search
Mol Weight	906.1 g/mol
Molecular Formula	C46H63N7O10S
Exact Mass	905.435712 g/mol

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SpectraBase Spectrum ID	IeQUc6uyh6h
Name	3-(1-tert-butoxycarbonylindol-3-yl)-2-[[2-[2-[2-[[2-[(5-dimethylamino-1-naphthyl)sulfonylamino]-4-methyl-pentanoyl]amino]propanoylamino]propanoylamino]-4-methyl-pentanoyl]amino]propionic acid
Copyright	Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula	C46H63N7O10S
InChI	InChI=1S/C46H63N7O10S/c1-26(2)22-34(42(56)50-36(44(58)59)24-30-25-53(45(60)63-46(7,8)9)38-19-13-12-16-31(30)38)49-41(55)29(6)47-40(54)28(5)48-43(57)35(23-27(3)4)51-64(61,62)39-21-15-17-32-33(39)18-14-20-37(32)52(10)11/h12-21,25-29,34-36,51H,22-24H2,1-11H3,(H,47,54)(H,48,57)(H,49,55)(H,50,56)(H,58,59)
InChIKey	WGQYODWRYLEQEU-UHFFFAOYSA-N
Literature Reference Author	ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation	UNI_MAINZ,INTERNAL_DB(2006)
Molecular Weight	906.107 g/mol
Source File Reference	MHKO20531