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9-[2-O-ACETYL-5-O-BENZOYL-4-C-[(BENZOYLOXY)-METHYL]-3-O-BENZYL-ALPHA-L-ERYTHRO-PENTOFURANOSYL]-6-N-BENZOYLADENINE
SpectraBase Compound ID ILzXFVidrr4
InChI InChI=1S/C41H35N5O9/c1-27(47)54-33-34(51-22-28-14-6-2-7-15-28)41(23-52-39(49)30-18-10-4-11-19-30,24-53-40(50)31-20-12-5-13-21-31)55-38(33)46-26-44-32-35(42-25-43-36(32)46)45-37(48)29-16-8-3-9-17-29/h2-21,25-26,33-34,38H,22-24H2,1H3,(H,42,43,45,48)/t33-,34+,38+/m1/s1
InChIKey RWYNMDWQVNXVNR-CYBCHLBCSA-N
Mol Weight 741.8 g/mol
Molecular Formula C41H35N5O9
Exact Mass 741.243478 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EpUdyj3Y8Td
Name 9-[2-O-ACETYL-5-O-BENZOYL-4-C-[(BENZOYLOXY)-METHYL]-3-O-BENZYL-ALPHA-L-ERYTHRO-PENTOFURANOSYL]-6-N-BENZOYLADENINE
Compound Number 14
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C41H35N5O9
InChI InChI=1S/C41H35N5O9/c1-27(47)54-33-34(51-22-28-14-6-2-7-15-28)41(23-52-39(49)30-18-10-4-11-19-30,24-53-40(50)31-20-12-5-13-21-31)55-38(33)46-26-44-32-35(42-25-43-36(32)46)45-37(48)29-16-8-3-9-17-29/h2-21,25-26,33-34,38H,22-24H2,1H3,(H,42,43,45,48)/t33-,34+,38+/m1/s1
InChIKey RWYNMDWQVNXVNR-CYBCHLBCSA-N
Literature Reference Author M.D.SORENSEN,L.KVAERNO,T.BRYLD,A.E.HAKANSSON,B.VERBEURE,G.GA UBERT,P.HERDEWIJN,J.
Literature Reference Citation J.AM.CHEM.SOC.,124,2164(2002)
Literature Reference DOI 10.1021/ja0168763
Molecular Weight 741.757 g/mol
Sample ID 47834
Solvent CDCl3