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.beta.-D-Glucopyranosiduronic acid, 4-[[1,1-dimethyl-2-[(trimethylsilyl)oxy]ethyl]amino]-6-(ethylamino)-1 ,3,5-triazin-2-yl 1-thio-2,3,4-tris-O-(trimethylsilyl)-, trimethylsilyl ester
SpectraBase Compound ID 9apq4jIpvjz
InChI InChI=1S/C30H65N5O7SSi5/c1-19-31-27-32-28(35-30(2,3)20-37-44(4,5)6)34-29(33-27)43-26-24(41-47(13,14)15)22(40-46(10,11)12)21(39-45(7,8)9)23(38-26)25(36)42-48(16,17)18/h21-24,26H,19-20H2,1-18H3,(H2,31,32,33,34,35)
InChIKey TZCFWPUMYGJIBO-UHFFFAOYSA-N
Mol Weight 780.4 g/mol
Molecular Formula C30H65N5O7SSi5
Exact Mass 779.345103 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EgliTwfHEx5
Name .beta.-D-Glucopyranosiduronic acid, 4-[[1,1-dimethyl-2-[(trimethylsilyl)oxy]ethyl]amino]-6-(ethylamino)-1 ,3,5-triazin-2-yl 1-thio-2,3,4-tris-O-(trimethylsilyl)-, trimethylsilyl ester
CAS Registry Number 68373-39-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H65N5O7SSi5
InChI InChI=1S/C30H65N5O7SSi5/c1-19-31-27-32-28(35-30(2,3)20-37-44(4,5)6)34-29(33-27)43-26-24(41-47(13,14)15)22(40-46(10,11)12)21(39-45(7,8)9)23(38-26)25(36)42-48(16,17)18/h21-24,26H,19-20H2,1-18H3,(H2,31,32,33,34,35)
InChIKey TZCFWPUMYGJIBO-UHFFFAOYSA-N
Molecular Weight 780.363 g/mol
SMILES N(c1nc(nc(n1)SC1OC(C(C(C1O[Si](C)(C)C)O[Si](C)(C)C)O[Si](C)(C)C)C(O[Si](C)(C)C)=O)NCC)C(CO[Si](C)(C)C)(C)C
SPLASH splash10-00nr-0097001000-84d7a0e3fe755b758d0c
Source of Spectrum BS-5-70-0
Synonyms Pertrimethylsilyl derivative of the s-glucuronide of 2-(ethylamino)-4-[(2-hydroxy-1,1-dimethyl)amino]-6-thio-s-triazine 4-({1,1-dimethyl-2-[(trimethylsilyl)oxy]ethyl}amino)-6-(ethylamino)-1,3,5-triazin-2-yl trimethylsilyl 1-thio-2,3,4-tris-O-(trimethylsilyl)hexopyranosiduronate Glucuronideof 2-(t-butylamino)-4-(ethylamino)-6-thio-S-triazine
Wiley ID 1416875