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1-(3'-AZIDO-3'-DEOXYTHYMIDIN-5'-YL)-5-(3,4,5-TRIMETHOXYBENZOIC-ACID)-PENTANEDIOATE
SpectraBase Compound ID KmAHlXT3gZg
InChI InChI=1S/C25H29N5O11/c1-13-11-30(25(35)27-23(13)33)19-10-15(28-29-26)18(40-19)12-39-20(31)6-5-7-21(32)41-24(34)14-8-16(36-2)22(38-4)17(9-14)37-3/h8-9,11,15,18-19H,5-7,10,12H2,1-4H3,(H,27,33,35)/t15-,18+,19+/m1/s1
InChIKey XCKRCYYLABEVPZ-MNEFBYGVSA-N
Mol Weight 575.53 g/mol
Molecular Formula C25H29N5O11
Exact Mass 575.186357 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JMnh3vJ22C
Name 1-(3'-AZIDO-3'-DEOXYTHYMIDIN-5'-YL)-5-(3,4,5-TRIMETHOXYBENZOIC-ACID)-PENTANEDIOATE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H29N5O11
InChI InChI=1S/C25H29N5O11/c1-13-11-30(25(35)27-23(13)33)19-10-15(28-29-26)18(40-19)12-39-20(31)6-5-7-21(32)41-24(34)14-8-16(36-2)22(38-4)17(9-14)37-3/h8-9,11,15,18-19H,5-7,10,12H2,1-4H3,(H,27,33,35)/t15-,18+,19+/m1/s1
InChIKey XCKRCYYLABEVPZ-MNEFBYGVSA-N
Literature Reference Author P.VLIEGHE,F.BIHEL,T.CLERC,C.PANNECOUQUE,M.WITVROUW,E.D.CLERC Q,J.P.SALLES,J.C.CHE
Literature Reference Citation J.MED.CHEM.,44,777(2001)
Literature Reference DOI 10.1021/jm001033s
Molecular Weight 575.532 g/mol
Sample ID 44325
Solvent CDCl3