| Record Information |
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| Version | 1.0 |
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| Creation Date | 2016-05-31 17:07:16 UTC |
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| Update Date | 2016-11-09 01:22:41 UTC |
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| Accession Number | CHEM042501 |
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| Identification |
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| Common Name | N-nitrosoproline |
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| Class | Small Molecule |
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| Description | Nitrosoproline is a nitroso derivative of the amino acid proline.
The mixture of nitrosoproline with sodium methoxide is known as PROLI/NO (also PROLINO or ProliNO). It is an "ultrafast" nitric oxide donor which is being studied for its research and clinical applications. |
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| Contaminant Sources | |
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| Contaminant Type | Not Available |
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| Chemical Structure | |
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| Synonyms | | Value | Source |
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| 1-Nitroso-L-proline | Kegg | | N-Nitrosoproline | MeSH | | Nitrosoproline, (D)-isomer | MeSH | | Nitrosoproline, (trans)-isomer | MeSH | | Nitrosoproline, 14C-labeled CPD | MeSH | | Nitrosoproline, (cis)-isomer | MeSH | | Nitrosoproline, (D,L)-isomer | MeSH | | Nitrosoproline | MeSH | | (2S)-1-Nitrosopyrrolidine-2-carboxylate | Generator | | N-nitroso-L-Proline | MeSH |
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| Chemical Formula | C5H8N2O3 |
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| Average Molecular Mass | 144.130 g/mol |
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| Monoisotopic Mass | 144.053 g/mol |
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| CAS Registry Number | Not Available |
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| IUPAC Name | (2S)-1-nitrosopyrrolidine-2-carboxylic acid |
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| Traditional Name | no-pro |
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| SMILES | [H][C@]1(CCCN1N=O)C(O)=O |
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| InChI Identifier | InChI=1S/C5H8N2O3/c8-5(9)4-2-1-3-7(4)6-10/h4H,1-3H2,(H,8,9)/t4-/m0/s1 |
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| InChI Key | WLKPHJWEIIAIFW-BYPYZUCNSA-N |
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| Chemical Taxonomy |
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| Description | belongs to the class of organic compounds known as proline and derivatives. Proline and derivatives are compounds containing proline or a derivative thereof resulting from reaction of proline at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom. |
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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 | Proline and derivatives |
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| Alternative Parents | |
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| Substituents | - Proline or derivatives
- Pyrrolidine carboxylic acid
- Pyrrolidine carboxylic acid or derivatives
- Pyrrolidine
- Organic n-nitroso compound
- Organic nitroso compound
- Carboxylic acid
- Monocarboxylic acid or derivatives
- Azacycle
- Organoheterocyclic compound
- Carbonyl group
- Hydrocarbon derivative
- Organic oxide
- Organopnictogen compound
- Organooxygen compound
- Organonitrogen compound
- Organic oxygen compound
- Organic nitrogen compound
- Aliphatic heteromonocyclic compound
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| Molecular Framework | Aliphatic heteromonocyclic compounds |
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| External Descriptors | |
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| Biological Properties |
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| Status | Detected and Not Quantified |
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| Origin | Not Available |
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| Cellular Locations | Not Available |
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| Biofluid Locations | Not Available |
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| Tissue Locations | Not Available |
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| Pathways | Not Available |
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| Applications | Not Available |
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| Biological Roles | Not Available |
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| Chemical Roles | Not Available |
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| Physical Properties |
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| State | Not Available |
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| Appearance | Not Available |
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| Experimental Properties | | Property | Value |
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| Melting Point | Not Available | | Boiling Point | Not Available | | Solubility | Not Available |
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| Predicted Properties | |
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| Spectra |
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| Spectra | | Spectrum Type | Description | Splash Key | View |
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| Predicted LC-MS/MS | Predicted LC-MS/MS Spectrum - 10V, Positive | splash10-002b-1900000000-b32f9e43a47b9e0b6de8 | Spectrum | | Predicted LC-MS/MS | Predicted LC-MS/MS Spectrum - 20V, Positive | splash10-002b-3900000000-6270db02d8c5ed32b11c | Spectrum | | Predicted LC-MS/MS | Predicted LC-MS/MS Spectrum - 40V, Positive | splash10-0006-9000000000-a1c320236270dc4eed38 | Spectrum | | Predicted LC-MS/MS | Predicted LC-MS/MS Spectrum - 10V, Negative | splash10-0007-4900000000-82205b3ceb33961915bd | Spectrum | | Predicted LC-MS/MS | Predicted LC-MS/MS Spectrum - 20V, Negative | splash10-002b-9600000000-6677642eaddc0719aec9 | Spectrum | | Predicted LC-MS/MS | Predicted LC-MS/MS Spectrum - 40V, Negative | splash10-0aor-9000000000-f704723dc0da8077e53a | Spectrum |
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| Toxicity Profile |
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| Route of Exposure | Not Available |
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| Mechanism of Toxicity | Not Available |
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| Metabolism | Not Available |
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| Toxicity Values | Not Available |
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| Lethal Dose | Not Available |
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| Carcinogenicity (IARC Classification) | Not Available |
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| Uses/Sources | Not Available |
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| Minimum Risk Level | Not Available |
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| Health Effects | Not Available |
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| Symptoms | Not Available |
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| Treatment | Not Available |
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| Concentrations |
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| Not Available |
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| External Links |
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| DrugBank ID | Not Available |
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| HMDB ID | Not Available |
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| FooDB ID | Not Available |
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| Phenol Explorer ID | Not Available |
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| KNApSAcK ID | Not Available |
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| BiGG ID | Not Available |
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| BioCyc ID | Not Available |
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| METLIN ID | Not Available |
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| PDB ID | Not Available |
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| Wikipedia Link | Nitrosoproline |
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| Chemspider ID | Not Available |
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| ChEBI ID | Not Available |
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| PubChem Compound ID | 10419304 |
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| Kegg Compound ID | C19485 |
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| YMDB ID | Not Available |
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| ECMDB ID | Not Available |
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| References |
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| Synthesis Reference | Not Available |
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| MSDS | Not Available |
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| General References | Not Available |
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