![N-METHYL-(R)-2-[(R)-2-(BENZYLOXYAMINO)-1-(ACETYLAMINO)-2-OXO-ETHYL]-5-PHENYLPENTANOYL-(S)-PHENYLALANINEAMIDE](/api/spectrum/KaHpHRmYwWW/structure.png?h=300&w=458 "N-METHYL-(R)-2-[(R)-2-(BENZYLOXYAMINO)-1-(ACETYLAMINO)-2-OXO-ETHYL]-5-PHENYLPENTANOYL-(S)-PHENYLALANINEAMIDE")
| SpectraBase Compound ID | 1OfDWuPC6iZ |
|---|---|
| InChI | InChI=1S/C32H38N4O5/c1-23(37)34-29(32(40)36-41-22-26-17-10-5-11-18-26)27(20-12-19-24-13-6-3-7-14-24)30(38)35-28(31(39)33-2)21-25-15-8-4-9-16-25/h3-11,13-18,27-29H,12,19-22H2,1-2H3,(H,33,39)(H,34,37)(H,35,38)(H,36,40)/t27-,28+,29-/m1/s1 |
| InChIKey | LKLGNSDWBZIFLE-SSBOKUKZSA-N |
| Mol Weight | 558.7 g/mol |
| Molecular Formula | C32H38N4O5 |
| Exact Mass | 558.28422 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KaHpHRmYwWW |
|---|---|
| Name | N-METHYL-(R)-2-[(R)-2-(BENZYLOXYAMINO)-1-(ACETYLAMINO)-2-OXO-ETHYL]-5-PHENYLPENTANOYL-(S)-PHENYLALANINEAMIDE |
| Compound Number | 11C |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C32H38N4O5 |
| InChI | InChI=1S/C32H38N4O5/c1-23(37)34-29(32(40)36-41-22-26-17-10-5-11-18-26)27(20-12-19-24-13-6-3-7-14-24)30(38)35-28(31(39)33-2)21-25-15-8-4-9-16-25/h3-11,13-18,27-29H,12,19-22H2,1-2H3,(H,33,39)(H,34,37)(H,35,38)(H,36,40)/t27-,28+,29-/m1/s1 |
| InChIKey | LKLGNSDWBZIFLE-SSBOKUKZSA-N |
| Literature Reference Author | J.L.BURKHART,B.DIEHL,M.J.SCHMITT,U.KAZMAIER |
| Literature Reference Citation | EUR.J.ORG.CHEM.,2012,567(2012) |
| Literature Reference DOI | 10.1002/ejoc.201101318 |
| Molecular Weight | 558.678 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWLU84326 |