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1-METHYL-7-NITRO-4[1-(2,3,5-TRI-O-BENZOYL-BETA-D-RIBOFURANOSYL)-OXO]-1,3-DIHYDRO-2H-BENZODIAZEPIN-2-ONE
SpectraBase Compound ID 4SqgwuwWe2A
InChI InChI=1S/C36H29N3O10/c1-38-28-18-17-25(39(44)45)19-26(28)37-27(20-30(38)40)31-33(49-36(43)24-15-9-4-10-16-24)32(48-35(42)23-13-7-3-8-14-23)29(47-31)21-46-34(41)22-11-5-2-6-12-22/h2-20,29,31-33,37H,21H2,1H3/t29-,31+,32-,33+/m0/s1
InChIKey ZUUWKGULQQHRQT-CVDVVEHVSA-N
Mol Weight 663.6 g/mol
Molecular Formula C36H29N3O10
Exact Mass 663.185294 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID D61mMQs3fCE
Name 1-METHYL-7-NITRO-4[1-(2,3,5-TRI-O-BENZOYL-BETA-D-RIBOFURANOSYL)-OXO]-1,3-DIHYDRO-2H-BENZODIAZEPIN-2-ONE
Compound Number 5C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C36H29N3O10
InChI InChI=1S/C36H29N3O10/c1-38-28-18-17-25(39(44)45)19-26(28)37-27(20-30(38)40)31-33(49-36(43)24-15-9-4-10-16-24)32(48-35(42)23-13-7-3-8-14-23)29(47-31)21-46-34(41)22-11-5-2-6-12-22/h2-20,29,31-33,37H,21H2,1H3/t29-,31+,32-,33+/m0/s1
InChIKey ZUUWKGULQQHRQT-CVDVVEHVSA-N
Literature Reference Author Y.ITO,M.WAKIMURA,C.ITO,I.MAEBA
Literature Reference Citation HETEROCYCLES,34,955(1992)
Literature Reference DOI 10.3987/COM-91-5966
Molecular Weight 663.640 g/mol
Solvent CDCl3
Source File Reference UWGE2413