For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
9-(3,6-DI-O-BENZOYL-2,4-DIDEOXY-ALPHA-D-ERYTHRO-HEXO-PYRANOSYL)-N-ACETYL-O-(DIPHENYLCARBAMOYL)-GUANINE
SpectraBase Compound ID 8K3tOFZyA6l
InChI InChI=1S/C40H34N6O8/c1-26(47)42-39-43-35-34(36(44-39)54-40(50)46(29-18-10-4-11-19-29)30-20-12-5-13-21-30)41-25-45(35)33-23-31(53-38(49)28-16-8-3-9-17-28)22-32(52-33)24-51-37(48)27-14-6-2-7-15-27/h2-21,25,31-33H,22-24H2,1H3,(H,42,43,44,47)/t31-,32+,33+/m0/s1
InChIKey PARPKZQYJMCIAB-WIHCDAFUSA-N
Mol Weight 726.7 g/mol
Molecular Formula C40H34N6O8
Exact Mass 726.243812 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 5RzM4BlpL4z
Name 9-(3,6-DI-O-BENZOYL-2,4-DIDEOXY-ALPHA-D-ERYTHRO-HEXO-PYRANOSYL)-N-ACETYL-O-(DIPHENYLCARBAMOYL)-GUANINE
Compound Number 20B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C40H34N6O8
InChI InChI=1S/C40H34N6O8/c1-26(47)42-39-43-35-34(36(44-39)54-40(50)46(29-18-10-4-11-19-29)30-20-12-5-13-21-30)41-25-45(35)33-23-31(53-38(49)28-16-8-3-9-17-28)22-32(52-33)24-51-37(48)27-14-6-2-7-15-27/h2-21,25,31-33H,22-24H2,1H3,(H,42,43,44,47)/t31-,32+,33+/m0/s1
InChIKey PARPKZQYJMCIAB-WIHCDAFUSA-N
Literature Reference Author K.AUGUSTYNS,J.ROZENSKI,A.VANAERSCHOT,G.JANSSEN,P.HERDEWIJN
Literature Reference Citation J.ORG.CHEM.,58,2977(1993)
Literature Reference DOI 10.1021/jo00063a013
Molecular Weight 726.745 g/mol
Solvent CDCl3