#10;(2S,2'S)-2,2'-[[2,2'-DIAMINO-4,4',6-TRIOXO-1,4,4',6,7,7'-HEXAHYDRO-1'H,5H-5,6'-BIPYRROLO-[2,3-D]-PYRIMIDINE-5,5'-DIYL]-BIS-(ETHYLENEBENZENE-4,1-DIYL

SpectraBase Compound ID	GRltcvnqCXG
InChI	InChI=1S/C40H40N10O13/c41-38-47-29-26(33(57)49-38)21(10-5-17-1-6-19(7-2-17)31(55)43-22(35(59)60)11-13-24(51)52)28(45-29)40(27-30(46-37(40)63)48-39(42)50-34(27)58)16-15-18-3-8-20(9-4-18)32(56)44-23(36(61)62)12-14-25(53)54/h1-4,6-9,22-23H,5,10-16H2,(H,43,55)(H,44,56)(H,51,52)(H,53,54)(H,59,60)(H,61,62)(H4,41,45,47,49,57)(H4,42,46,48,50,58,63)/t22-,23-,40?/m0/s1
InChIKey	MYCCYMLLSPAQLR-SRBWTXITSA-N Google Search
Mol Weight	868.8 g/mol
Molecular Formula	C40H40N10O13
Exact Mass	868.277631 g/mol

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SpectraBase Spectrum ID	GQnuEWmqlP8
Name	#10;(2S,2'S)-2,2'-[[2,2'-DIAMINO-4,4',6-TRIOXO-1,4,4',6,7,7'-HEXAHYDRO-1'H,5H-5,6'-BIPYRROLO-[2,3-D]-PYRIMIDINE-5,5'-DIYL]-BIS-(ETHYLENEBENZENE-4,1-DIYL
Copyright	Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula	C40H40N10O13
InChI	InChI=1S/C40H40N10O13/c41-38-47-29-26(33(57)49-38)21(10-5-17-1-6-19(7-2-17)31(55)43-22(35(59)60)11-13-24(51)52)28(45-29)40(27-30(46-37(40)63)48-39(42)50-34(27)58)16-15-18-3-8-20(9-4-18)32(56)44-23(36(61)62)12-14-25(53)54/h1-4,6-9,22-23H,5,10-16H2,(H,43,55)(H,44,56)(H,51,52)(H,53,54)(H,59,60)(H,61,62)(H4,41,45,47,49,57)(H4,42,46,48,50,58,63)/t22-,23-,40?/m0/s1
InChIKey	MYCCYMLLSPAQLR-SRBWTXITSA-N
Literature Reference Author	O.MICHALAK,M.M.GRUZA,A.WITKOWSKA,I.BUJAK,P.CMOCH
Literature Reference Citation	MOLECULES,20,10004(2015)
Literature Reference DOI	10.3390/molecules200610004
Solvent	DMSO-D6
Source File Reference	UWPA3203