| SpectraBase Compound ID | JzJms10OeON |
|---|---|
| InChI | InChI=1S/2C14H21N5O9/c2*1-5(15)10(23)16-6(2-3-20)11(24)17-7(14(26)27)4-8(21)28-13-9(22)12(25)18-19-13/h2*5-7,20,22H,2-4,15H2,1H3,(H,16,23)(H,17,24)(H,26,27)(H2,18,19,25) |
| InChIKey | VJRZLLIHJTVMQP-UHFFFAOYSA-N |
| Mol Weight | 806.7 g/mol |
| Molecular Formula | C28H42N10O18 |
| Exact Mass | 806.267855 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7wtd8GaPTE2 |
|---|---|
| Name | 3-(L-ALANYL-L-HOMOSERINYL-L-ASPARTYL-BETA-CARBOXY)-4-YHDROXY-5-OXOPYRAZOLE |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C28H42N10O18 |
| InChI | InChI=1S/2C14H21N5O9/c2*1-5(15)10(23)16-6(2-3-20)11(24)17-7(14(26)27)4-8(21)28-13-9(22)12(25)18-19-13/h2*5-7,20,22H,2-4,15H2,1H3,(H,16,23)(H,17,24)(H,26,27)(H2,18,19,25) |
| InChIKey | VJRZLLIHJTVMQP-UHFFFAOYSA-N |
| Literature Reference Author | R.E.MITCHELL,D.R.GREENWOOD,V.SAROJINI |
| Literature Reference Citation | PHYTOCHEM.,69,2704(2008) |
| Literature Reference DOI | 10.1016/j.phytochem.2008.08.013 |
| Molecular Weight | 806.698 g/mol |
| Sample ID | 63138 |
| Solvent | D2O |