John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=4hL1MfmJzBg SpectraBase Spectrum ID=3LqoGUADHmQ

(accessed ).
2-(3-BENZOYLPHENYL)-PROPIONIC-ACID-3-[2-[3-[3-[2-(3-BENZOYLPHENYL)-PROPIONYLOXY]-PROPYL]-UREIDO]-4-METHYL-PENTANOYLAMINO]-PROPYLESTER
SpectraBase Compound ID 4hL1MfmJzBg
InChI InChI=1S/C45H51N3O8/c1-30(2)27-39(42(51)46-23-13-25-55-43(52)31(3)35-19-11-21-37(28-35)40(49)33-15-7-5-8-16-33)48-45(54)47-24-14-26-56-44(53)32(4)36-20-12-22-38(29-36)41(50)34-17-9-6-10-18-34/h5-12,15-22,28-32,39H,13-14,23-27H2,1-4H3,(H,46,51)(H2,47,48,54)
InChIKey XGZGBZYXYMZNAW-UHFFFAOYSA-N
Mol Weight 761.9 g/mol
Molecular Formula C45H51N3O8
Exact Mass 761.367616 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 3LqoGUADHmQ
Name 2-(3-BENZOYLPHENYL)-PROPIONIC-ACID-3-[2-[3-[3-[2-(3-BENZOYLPHENYL)-PROPIONYLOXY]-PROPYL]-UREIDO]-4-METHYL-PENTANOYLAMINO]-PROPYLESTER
Compound Number 6D
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C45H51N3O8
InChI InChI=1S/C45H51N3O8/c1-30(2)27-39(42(51)46-23-13-25-55-43(52)31(3)35-19-11-21-37(28-35)40(49)33-15-7-5-8-16-33)48-45(54)47-24-14-26-56-44(53)32(4)36-20-12-22-38(29-36)41(50)34-17-9-6-10-18-34/h5-12,15-22,28-32,39H,13-14,23-27H2,1-4H3,(H,46,51)(H2,47,48,54)
InChIKey XGZGBZYXYMZNAW-UHFFFAOYSA-N
Literature Reference Author I.PERKOVIC,Z.R.DZOLIC,B.ZORC
Literature Reference Citation ACTA.PHARM.,63,409(2013)
Molecular Weight 761.915 g/mol
Solvent DMSO-D6
Source File Reference UWLU78931
SpectraBase Batch ID 74QHX2n710k