| Record Information |
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| Version | 1.0 |
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| Creation Date | 2016-09-30 22:45:36 UTC |
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| Update Date | 2020-06-04 20:52:34 UTC |
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| BMDB ID | BMDB0001414 |
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| Secondary Accession Numbers | |
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| Metabolite Identification |
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| Common Name | Putrescine |
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| Description | Putrescine, also known as 1,4-butanediamine or 1,4-diaminobutane, belongs to the class of organic compounds known as monoalkylamines. These are organic compounds containing an primary aliphatic amine group. Putrescine exists as a solid, possibly soluble (in water), and a very strong basic compound (based on its pKa) molecule. Putrescine exists in all living species, ranging from bacteria to humans. Putrescine is a potentially toxic compound. |
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| Structure | |
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| Synonyms | | Value | Source |
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| 1,4-Butanediamine | ChEBI | | 1,4-Butylenediamine | ChEBI | | 1,4-DIAMINOBUTANE | ChEBI | | 1,4-Tetramethylenediamine | ChEBI | | Butane-1,4-diamine | ChEBI | | Butylenediamine | ChEBI | | H2N(CH2)4nh2 | ChEBI | | Putrescin | ChEBI | | Putrescina | ChEBI | | Putreszin | ChEBI | | Tetramethylendiamin | ChEBI | | Tetramethylenediamine | ChEBI | | 1,4-Butanediammonium | HMDB | | Tetramethyldiamine | HMDB | | 1,4 Diaminobutane | HMDB | | 1,4 Butanediamine | HMDB |
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| Chemical Formula | C4H12N2 |
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| Average Molecular Weight | 88.1515 |
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| Monoisotopic Molecular Weight | 88.100048394 |
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| IUPAC Name | butane-1,4-diamine |
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| Traditional Name | putrescine |
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| CAS Registry Number | 110-60-1 |
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| SMILES | NCCCCN |
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| InChI Identifier | InChI=1S/C4H12N2/c5-3-1-2-4-6/h1-6H2 |
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| InChI Key | KIDHWZJUCRJVML-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Description | belongs to the class of organic compounds known as monoalkylamines. These are organic compounds containing an primary aliphatic amine group. |
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| Kingdom | Organic compounds |
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| Super Class | Organic nitrogen compounds |
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| Class | Organonitrogen compounds |
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| Sub Class | Amines |
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| Direct Parent | Monoalkylamines |
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| Alternative Parents | |
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| Substituents | - Organopnictogen compound
- Hydrocarbon derivative
- Primary aliphatic amine
- Aliphatic acyclic compound
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| Molecular Framework | Aliphatic acyclic compounds |
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| External Descriptors | |
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| Ontology |
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| Status | Detected and Quantified |
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| Origin | |
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| Biofunction | Not Available |
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| Application | Not Available |
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| Cellular locations | |
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| Physical Properties |
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| State | Solid |
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| Experimental Properties | | Property | Value | Reference |
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| Melting Point | 27.5 °C | Not Available | | Boiling Point | Not Available | Not Available | | Water Solubility | Not Available | Not Available | | LogP | -0.7 | SANGSTER (1994) |
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| Predicted Properties | |
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| Spectra |
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| Spectra | |
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| Biological Properties |
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| Cellular Locations | |
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| Biospecimen Locations | - Blood
- Brain
- Colostrum
- Epidermis
- Erythrocyte
- Fibroblasts
- Liver
- Longissimus Thoracis Muscle
- Mammary Gland
- Milk
- Muscle
- Neuron
- Placenta
- Platelet
- Prostate Tissue
- Ruminal Fluid
- Semimembranosus Muscle
- Testis
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| Pathways | |
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| Normal Concentrations |
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| Blood | Detected and Quantified | 0.04 +/- 0.02 uM | Not Specified | Not Specified | Normal | | details | | Blood | Detected but not Quantified | Not Quantified | Not Specified | Not Specified | Normal | | details | | Brain | Expected but not Quantified | Not Quantified | Not Specified | Not Specified | Normal | | details | | Epidermis | Expected but not Quantified | Not Quantified | Not Specified | Not Specified | Normal | | details | | Erythrocyte | Expected but not Quantified | Not Quantified | Not Specified | Not Specified | Normal | | details | | Fibroblasts | Expected but not Quantified | Not Quantified | Not Specified | Not Specified | Normal | | details | | Liver | Detected and Quantified | 0.2 +/- 0.1 nmol/g of tissue | Not Specified | Not Specified | Normal | | details | | Longissimus Thoracis Muscle | Detected and Quantified | 1.3 +/- 0.4 nmol/g of tissue | Not Specified | Not Specified | Normal | | details | | Mammary Gland | Detected but not Quantified | Not Quantified | Not Specified | Not Specified | Normal | | details | | Mammary Gland | Detected but not Quantified | Not Quantified | Not Specified | Not Specified | Normal | | details | | Milk | Detected but not Quantified | Not Quantified | Not Specified | Not Specified | Normal | | details | | Milk | Detected but not Quantified | Not Quantified | Not Specified | Not Specified | Normal | | details | | Muscle | Detected and Quantified | 9-22 nmol/g of tissue | Not Specified | Not Specified | Normal | | details | | Neuron | Expected but not Quantified | Not Quantified | Not Specified | Not Specified | Normal | | details | | Placenta | Expected but not Quantified | Not Quantified | Not Specified | Not Specified | Normal | | details | | Platelet | Expected but not Quantified | Not Quantified | Not Specified | Not Specified | Normal | | details | | Prostate Tissue | Expected but not Quantified | Not Quantified | Not Specified | Not Specified | Normal | | details | | Ruminal Fluid | Detected and Quantified | 103 +/- 58 uM | Not Specified | Not Specified | Normal | | details | | Ruminal Fluid | Detected and Quantified | 26.31 +/- 12.21 uM | Not Specified | Not Specified | Normal | | details | | Ruminal Fluid | Detected and Quantified | 52.2 uM | Not Specified | Not Specified | Normal | | details | | Ruminal Fluid | Detected and Quantified | 122.2 uM | Not Specified | Not Specified | Normal | | details | | Ruminal Fluid | Detected and Quantified | 314.7 uM | Not Specified | Not Specified | Normal | | details | | Ruminal Fluid | Detected and Quantified | 26.4 uM | Not Specified | Not Specified | Normal | | details | | Ruminal Fluid | Detected and Quantified | 29-111 uM | Not Specified | Not Specified | Normal | | details | | Ruminal Fluid | Detected and Quantified | 52 +/- 17 uM | Not Specified | Not Specified | Normal | | details | | Ruminal Fluid | Detected and Quantified | 122 +/- 29 uM | Not Specified | Not Specified | Normal | | details | | Ruminal Fluid | Detected and Quantified | 214 +/- 89 uM | Not Specified | Not Specified | Normal | | details | | Ruminal Fluid | Detected and Quantified | 28 +/- 12 uM | Not Specified | Not Specified | Normal | | details | | Ruminal Fluid | Detected and Quantified | 28.0 +/- 12.0 uM | Not Specified | Not Specified | Normal | | details | | Semimembranosus Muscle | Detected and Quantified | 2 +/- 1 nmol/g of tissue | Not Specified | Not Specified | Normal | | details | | Testis | Detected and Quantified | 11 +/- 3 nmol/g of tissue | Not Specified | Not Specified | Normal | | details |
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| Abnormal Concentrations |
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| Colostrum | Detected but not Quantified | Not Quantified | Not Specified | Not Specified | Commercial Product/bacterial growth on ground beef | | details | | Muscle | Detected but not Quantified | Not Quantified | Not Specified | Not Specified | Commercial Product/bacterial growth on ground beef | | details | | Ruminal Fluid | Detected and Quantified | 314.76 +/- 86.14 uM | Not Specified | Not Specified | Rumen acidosis | | details |
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| External Links |
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| HMDB ID | HMDB0001414 |
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| DrugBank ID | DB01917 |
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| Phenol Explorer Compound ID | Not Available |
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| FooDB ID | FDB001494 |
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| KNApSAcK ID | C00001428 |
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| Chemspider ID | 13837702 |
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| KEGG Compound ID | C00134 |
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| BioCyc ID | PUTRESCINE |
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| BiGG ID | 33980 |
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| Wikipedia Link | Putrescine |
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| METLIN ID | 3226 |
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| PubChem Compound | 1045 |
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| PDB ID | Not Available |
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| ChEBI ID | 17148 |
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| References |
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| Synthesis Reference | Dudley, H. W.; Thorpe, W. V. Synthesis of N-methylputrescine and of putrescine. Biochemical Journal (1925), 19 845-9. |
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| Material Safety Data Sheet (MSDS) | Not Available |
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| General References | - Sun HZ, Wang DM, Wang B, Wang JK, Liu HY, Guan le L, Liu JX: Metabolomics of four biofluids from dairy cows: potential biomarkers for milk production and quality. J Proteome Res. 2015 Feb 6;14(2):1287-98. doi: 10.1021/pr501305g. Epub 2015 Jan 28. [PubMed:25599412 ]
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