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#5D;6-[[6-ANTHRACEN-9-YL-4-(1H-INDOL-3-YL)-PYRIDAZIN-3-YL]-HYDRAZONO]-3-(3,4,5-TRIHYDROXY-6-HYDROXY-METHYLTETRAHYDROPYRAN-2-YLOXY)-HEXANE-1,2,4,5-TETRAOL

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#5D;6-[[6-ANTHRACEN-9-YL-4-(1H-INDOL-3-YL)-PYRIDAZIN-3-YL]-HYDRAZONO]-3-(3,4,5-TRIHYDROXY-6-HYDROXY-METHYLTETRAHYDROPYRAN-2-YLOXY)-HEXANE-1,2,4,5-TETRAOL
SpectraBase Compound ID JvDVN4D5KR6
InChI InChI=1S/C38H39N5O10/c44-17-29(47)36(53-38-35(51)34(50)33(49)30(18-45)52-38)32(48)28(46)16-40-42-37-24(25-15-39-26-12-6-5-11-23(25)26)14-27(41-43-37)31-21-9-3-1-7-19(21)13-20-8-2-4-10-22(20)31/h1-16,28-30,32-36,38-39,44-51H,17-18H2,(H,42,43)/b40-16+
InChIKey BZUXWMNSHPMPLG-YQOHXEDVSA-N
Mol Weight 725.8 g/mol
Molecular Formula C38H39N5O10
Exact Mass 725.269692 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 14e94AuEOaM
Name #5D;6-[[6-ANTHRACEN-9-YL-4-(1H-INDOL-3-YL)-PYRIDAZIN-3-YL]-HYDRAZONO]-3-(3,4,5-TRIHYDROXY-6-HYDROXY-METHYLTETRAHYDROPYRAN-2-YLOXY)-HEXANE-1,2,4,5-TETRAOL
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C38H39N5O10
InChI InChI=1S/C38H39N5O10/c44-17-29(47)36(53-38-35(51)34(50)33(49)30(18-45)52-38)32(48)28(46)16-40-42-37-24(25-15-39-26-12-6-5-11-23(25)26)14-27(41-43-37)31-21-9-3-1-7-19(21)13-20-8-2-4-10-22(20)31/h1-16,28-30,32-36,38-39,44-51H,17-18H2,(H,42,43)/b40-16+
InChIKey BZUXWMNSHPMPLG-YQOHXEDVSA-N
Literature Reference Author S.A.ABUBSHAIT
Literature Reference Citation MOLECULES,12,25(2007)
Literature Reference DOI 10.3390/12010025
Molecular Weight 725.755 g/mol
Sample ID 46312
Solvent DMSO-D6