| Record Information |
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| Version | 1.0 |
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| Creation date | 2011-09-21 00:31:48 UTC |
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| Update date | 2015-07-21 06:57:46 UTC |
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| Primary ID | FDB023573 |
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| Secondary Accession Numbers | Not Available |
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| Chemical Information |
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| FooDB Name | m-Tyramine |
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| Description | m-Tyramine belongs to the class of organic compounds known as phenethylamines. Phenethylamines are compounds containing a phenethylamine moiety, which consists of a phenyl group substituted at the second position by an ethan-1-amine. m-Tyramine is a very strong basic compound (based on its pKa). |
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| CAS Number | 588-05-6 |
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| Structure | |
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| Synonyms | | Synonym | Source |
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| 2-(3-Hydroxyphenyl)ethylamine | HMDB | | 3-(2-Aminoethyl)phenol | HMDB | | 3-Hydroxyphenethylamine | HMDB | | 3-Hydroxyphenylethylamine | HMDB | | 3-Tyramine | HMDB | | m-Hydroxyphenethylamine | HMDB | | Meta-tyramine | HMDB | | Metatyramine | HMDB | | 3-Tyramine hydrobromide | HMDB | | 3-Tyramine hydrochloride | HMDB | | m-Tyramine | MeSH | | 2-(3-hydroxyphenyl)ethylamine | hmdb | | 3-(2-aminoethyl)phenol | hmdb | | 3-hydroxyphenethylamine | hmdb | | 3-hydroxyphenylethylamine | hmdb | | 3-tyramine | hmdb | | M-hydroxyphenethylamine | hmdb |
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| Predicted Properties | |
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| Chemical Formula | C8H11NO |
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| IUPAC name | 3-(2-aminoethyl)phenol |
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| InChI Identifier | InChI=1S/C8H11NO/c9-5-4-7-2-1-3-8(10)6-7/h1-3,6,10H,4-5,9H2 |
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| InChI Key | GHFGJTVYMNRGBY-UHFFFAOYSA-N |
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| Isomeric SMILES | NCCC1=CC(O)=CC=C1 |
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| Average Molecular Weight | 137.179 |
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| Monoisotopic Molecular Weight | 137.084063979 |
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| Classification |
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| Description | belongs to the class of organic compounds known as phenethylamines. Phenethylamines are compounds containing a phenethylamine moiety, which consists of a phenyl group substituted at the second position by an ethan-1-amine. |
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| Kingdom | Organic compounds |
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| Super Class | Benzenoids |
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| Class | Benzene and substituted derivatives |
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| Sub Class | Phenethylamines |
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| Direct Parent | Phenethylamines |
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| Alternative Parents | |
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| Substituents | - Phenethylamine
- 2-arylethylamine
- 1-hydroxy-4-unsubstituted benzenoid
- 1-hydroxy-2-unsubstituted benzenoid
- Phenol
- Aralkylamine
- Amine
- Hydrocarbon derivative
- Organopnictogen compound
- Primary amine
- Organic oxygen compound
- Organic nitrogen compound
- Organooxygen compound
- Organonitrogen compound
- Primary aliphatic amine
- Aromatic homomonocyclic compound
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| Molecular Framework | Aromatic homomonocyclic compounds |
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| External Descriptors | Not Available |
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| Ontology |
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| Physiological effect | Health effect: |
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| Disposition | Source: Biological location: |
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| Physico-Chemical Properties - Experimental |
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| Physico-Chemical Properties - Experimental | | Property | Value | Reference |
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| Physical state | Solid | |
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| Physical Description | Not Available | |
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| Mass Composition | Not Available | |
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| Melting Point | Not Available | |
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| Boiling Point | Not Available | |
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| Experimental Water Solubility | Not Available | |
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| Experimental logP | Not Available | |
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| Experimental pKa | Not Available | |
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| Isoelectric point | Not Available | |
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| Charge | Not Available | |
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| Optical Rotation | Not Available | |
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| Spectroscopic UV Data | Not Available | |
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| Density | Not Available | |
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| Refractive Index | Not Available | |
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| Spectra |
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| Spectra | |
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| External Links |
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| ChemSpider ID | 11008 |
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| ChEMBL ID | CHEMBL145584 |
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| KEGG Compound ID | Not Available |
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| Pubchem Compound ID | 11492 |
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| Pubchem Substance ID | Not Available |
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| ChEBI ID | Not Available |
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| Phenol-Explorer ID | Not Available |
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| DrugBank ID | Not Available |
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| HMDB ID | HMDB04989 |
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| CRC / DFC (Dictionary of Food Compounds) ID | Not Available |
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| EAFUS ID | Not Available |
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| Dr. Duke ID | Not Available |
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| BIGG ID | Not Available |
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| KNApSAcK ID | Not Available |
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| HET ID | Not Available |
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| Food Biomarker Ontology | Not Available |
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| VMH ID | Not Available |
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| Flavornet ID | Not Available |
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| GoodScent ID | Not Available |
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| SuperScent ID | Not Available |
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| Wikipedia ID | Not Available |
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| Phenol-Explorer Metabolite ID | Not Available |
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| Duplicate IDS | Not Available |
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| Old DFC IDS | Not Available |
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| Associated Foods |
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| Food | Content Range | Average | Reference |
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| Food | | | Reference |
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| Biological Effects and Interactions |
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| Health Effects / Bioactivities | Not Available |
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| Enzymes | Not Available |
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| Pathways | Not Available |
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| Metabolism | Not Available |
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| Biosynthesis | Not Available |
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| Organoleptic Properties |
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| Flavours | Not Available |
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| Files |
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| MSDS | Not Available |
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| References |
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| Synthesis Reference | Not Available |
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| General Reference | Not Available |
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| Content Reference | |
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