![N-{[2-(D-manno-Pentitol-1-yl)-4-(4-hydroxybenzyl)-5-oxoimidazolidin-1-yl]acetyl}glycyl-L-phenylalanyl-L-leucine](/api/spectrum/6iwKUjNsrJT/structure.png?h=300&w=458 "N-{[2-(D-manno-Pentitol-1-yl)-4-(4-hydroxybenzyl)-5-oxoimidazolidin-1-yl]acetyl}glycyl-L-phenylalanyl-L-leucine")
| SpectraBase Compound ID | 1Efis9XlysZ |
|---|---|
| InChI | InChI=1S/C34H47N5O12/c1-18(2)12-24(34(50)51)38-32(48)22(13-19-6-4-3-5-7-19)36-26(43)15-35-27(44)16-39-31(30(47)29(46)28(45)25(42)17-40)37-23(33(39)49)14-20-8-10-21(41)11-9-20/h3-11,18,22-25,28-31,37,40-42,45-47H,12-17H2,1-2H3,(H,35,44)(H,36,43)(H,38,48)(H,50,51) |
| InChIKey | LNSPLTWYVDUATH-UHFFFAOYSA-N |
| Mol Weight | 717.8 g/mol |
| Molecular Formula | C34H47N5O12 |
| Exact Mass | 717.322122 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6iwKUjNsrJT |
|---|---|
| Name | N-[[2-(D-MANNO-PENTITOL-1-YL)-4-(4-HYDROXYBENZYL)-5-OXOIMIDAZOLIDIN-1-YL]-ACETYL]-GLYCYL-L-PHENYLALANYL-L-LEUCINE |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C34H47N5O12 |
| InChI | InChI=1S/C34H47N5O12/c1-18(2)12-24(34(50)51)38-32(48)22(13-19-6-4-3-5-7-19)36-26(43)15-35-27(44)16-39-31(30(47)29(46)28(45)25(42)17-40)37-23(33(39)49)14-20-8-10-21(41)11-9-20/h3-11,18,22-25,28-31,37,40-42,45-47H,12-17H2,1-2H3,(H,35,44)(H,36,43)(H,38,48)(H,50,51) |
| InChIKey | LNSPLTWYVDUATH-UHFFFAOYSA-N |
| Literature Reference Author | L.VARGA-DEFTERDAROVIC,D.VIKIC-TOPIC,S.HORVAT |
| Literature Reference Citation | J.CHEM.SOC.PERKIN-1,2829(1999) |
| Literature Reference DOI | 10.1039/a902522g |
| Molecular Weight | 717.773 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWRU8881 |