Record Information |
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Version | 1.0 |
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Created at | 2021-01-05 21:00:35 UTC |
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Updated at | 2021-07-15 17:08:23 UTC |
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NP-MRD ID | NP0011252 |
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Secondary Accession Numbers | None |
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Natural Product Identification |
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Common Name | N-(2-aminoethyl)-glycine |
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Provided By | NPAtlas |
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Description | 2-[(2-Aminoethyl)amino]acetic acid belongs to the class of organic compounds known as alpha amino acids. These are amino acids in which the amino group is attached to the carbon atom immediately adjacent to the carboxylate group (alpha carbon). N-(2-aminoethyl)-glycine is found in Cyanobacterium. It was first documented in 2005 (PMID: 15809158). Based on a literature review a small amount of articles have been published on 2-[(2-aminoethyl)amino]acetic acid (PMID: 23145061) (PMID: 32838227) (PMID: 25113858) (PMID: 20162588). |
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Structure | [H]OC(=O)C([H])([H])N([H])C([H])([H])C([H])([H])N([H])[H] InChI=1S/C4H10N2O2/c5-1-2-6-3-4(7)8/h6H,1-3,5H2,(H,7,8) |
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Synonyms | Value | Source |
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2-[(2-Aminoethyl)amino]acetate | Generator | N-(2-Aminoethyl)glycine dihydrate | MeSH | N-2-Aminoethylglycine | MeSH | 2-((2-Ammonioethyl)ammonio)acetate iodide | MeSH | N-(2-Aminoethyl)glycine monosodium salt | MeSH | 2-((2-Ammonioethyl)amino)acetate dihydrate | MeSH |
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Chemical Formula | C4H10N2O2 |
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Average Mass | 118.1360 Da |
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Monoisotopic Mass | 118.07423 Da |
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IUPAC Name | 2-[(2-aminoethyl)amino]acetic acid |
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Traditional Name | [(2-aminoethyl)amino]acetic acid |
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CAS Registry Number | Not Available |
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SMILES | NCCNCC(O)=O |
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InChI Identifier | InChI=1S/C4H10N2O2/c5-1-2-6-3-4(7)8/h6H,1-3,5H2,(H,7,8) |
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InChI Key | PIINGYXNCHTJTF-UHFFFAOYSA-N |
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Experimental Spectra |
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| Not Available | Predicted Spectra |
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| Spectrum Type | Description | Depositor ID | Depositor Organization | Depositor | Deposition Date | View |
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1D NMR | 13C NMR Spectrum (1D, 25 MHz, D2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 1H NMR Spectrum (1D, 100 MHz, D2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 13C NMR Spectrum (1D, 252 MHz, D2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 1H NMR Spectrum (1D, 1000 MHz, D2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 13C NMR Spectrum (1D, 50 MHz, D2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 1H NMR Spectrum (1D, 200 MHz, D2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 13C NMR Spectrum (1D, 75 MHz, D2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 1H NMR Spectrum (1D, 300 MHz, D2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 13C NMR Spectrum (1D, 101 MHz, D2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 1H NMR Spectrum (1D, 400 MHz, D2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 13C NMR Spectrum (1D, 126 MHz, D2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 1H NMR Spectrum (1D, 500 MHz, D2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 13C NMR Spectrum (1D, 151 MHz, D2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 1H NMR Spectrum (1D, 600 MHz, D2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 13C NMR Spectrum (1D, 176 MHz, D2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 1H NMR Spectrum (1D, 700 MHz, D2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 13C NMR Spectrum (1D, 201 MHz, D2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 1H NMR Spectrum (1D, 800 MHz, D2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 13C NMR Spectrum (1D, 226 MHz, D2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum | 1D NMR | 1H NMR Spectrum (1D, 900 MHz, D2O, predicted) | Wishart Lab | Wishart Lab | David Wishart | 2021-06-20 | View Spectrum |
| Chemical Shift Submissions |
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| Not Available | Species |
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Species of Origin | |
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Chemical Taxonomy |
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Description | Belongs to the class of organic compounds known as alpha amino acids. These are amino acids in which the amino group is attached to the carbon atom immediately adjacent to the carboxylate group (alpha carbon). |
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Kingdom | Organic compounds |
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Super Class | Organic acids and derivatives |
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Class | Carboxylic acids and derivatives |
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Sub Class | Amino acids, peptides, and analogues |
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Direct Parent | Alpha amino acids |
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Alternative Parents | |
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Substituents | - Alpha-amino acid
- Amino acid
- Carboxylic acid
- Secondary aliphatic amine
- Monocarboxylic acid or derivatives
- Secondary amine
- Carbonyl group
- Primary amine
- Organooxygen compound
- Organonitrogen compound
- Amine
- Primary aliphatic amine
- Organic nitrogen compound
- Hydrocarbon derivative
- Organic oxygen compound
- Organic oxide
- Organopnictogen compound
- Aliphatic acyclic compound
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Molecular Framework | Aliphatic acyclic compounds |
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External Descriptors | Not Available |
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Physical Properties |
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State | Not Available |
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Experimental Properties | Property | Value | Reference |
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Melting Point | Not Available | Not Available | Boiling Point | Not Available | Not Available | Water Solubility | Not Available | Not Available | LogP | Not Available | Not Available |
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Predicted Properties | |
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General References | - Banack SA, Metcalf JS, Jiang L, Craighead D, Ilag LL, Cox PA: Cyanobacteria produce N-(2-aminoethyl)glycine, a backbone for peptide nucleic acids which may have been the first genetic molecules for life on Earth. PLoS One. 2012;7(11):e49043. doi: 10.1371/journal.pone.0049043. Epub 2012 Nov 7. [PubMed:23145061 ]
- Singh KR, Sridevi P, Singh RP: Potential applications of peptide nucleic acid in biomedical domain. Eng Rep. 2020 Jul 24:e12238. doi: 10.1002/eng2.12238. [PubMed:32838227 ]
- Bhattacharyya S, Sarkar A, Dey SK, Mukherjee A: Effect of glucosamine conjugation to zinc(II) complexes of a bis-pyrazole ligand: syntheses, characterization and anticancer activity. J Inorg Biochem. 2014 Nov;140:131-42. doi: 10.1016/j.jinorgbio.2014.07.009. Epub 2014 Jul 22. [PubMed:25113858 ]
- Gratz A, Gotz C, Jose J: A CE-based assay for human protein kinase CK2 activity measurement and inhibitor screening. Electrophoresis. 2010 Jan;31(4):634-40. doi: 10.1002/elps.200900514. [PubMed:20162588 ]
- Ilic N, Habus I, Barkawi LS, Park S, Stefanic Z, Kojic-Prodic B, Cohen JD, Magnus V: Aminoethyl-substituted indole-3-acetic acids for the preparation of tagged and carrier-linked auxin. Bioorg Med Chem. 2005 May 2;13(9):3229-40. doi: 10.1016/j.bmc.2005.02.046. [PubMed:15809158 ]
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