| Record Information |
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| Version | 1.0 |
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| Creation Date | 2016-09-30 22:45:56 UTC |
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| Update Date | 2020-04-22 15:08:11 UTC |
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| BMDB ID | BMDB0001434 |
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| Secondary Accession Numbers | |
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| Metabolite Identification |
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| Common Name | 3-Methoxytyrosine |
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| Description | 3-Methoxytyrosine belongs to the class of organic compounds known as tyrosine and derivatives. Tyrosine and derivatives are compounds containing tyrosine or a derivative thereof resulting from reaction of tyrosine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom. Based on a literature review very few articles have been published on 3-Methoxytyrosine. |
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| Structure | |
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| Synonyms | | Value | Source |
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| 3-Methoxy-tyrosine | HMDB | | 3-O-Methyldopa | HMDB, MeSH | | L-3-Methoxy tyrosine | HMDB | | L-3-Methoxytyrosine | HMDB, MeSH | | L-4-Hydroxy-3-methoxyphenylalanine | HMDB | | Vanilalanine | HMDB | | 3-Methoxytyrosine, (L-tyr)-isomer | MeSH, HMDB | | 3-Methoxytyrosine, (D-tyr)-isomer | MeSH, HMDB | | 3-Methoxytyrosine, (L-tyr)-isomer, alpha-(14)C-labeled | MeSH, HMDB | | 3-Methoxytyrosine, (DL-tyr)-isomer | MeSH, HMDB | | 2-Amino-3-(4-hydroxy-3-methoxyphenyl)propanoate | Generator, HMDB | | 3-O-Methyl-dopa | MeSH, HMDB | | 3-OMD CPD | MeSH, HMDB | | 3-Methoxydopa | MeSH, HMDB | | 3-Methoxytyrosine | MeSH |
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| Chemical Formula | C10H13NO4 |
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| Average Molecular Weight | 211.2145 |
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| Monoisotopic Molecular Weight | 211.084457909 |
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| IUPAC Name | 2-amino-3-(4-hydroxy-3-methoxyphenyl)propanoic acid |
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| Traditional Name | 3-O-methyldopa |
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| CAS Registry Number | 7636-26-2 |
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| SMILES | COC1=C(O)C=CC(CC(N)C(O)=O)=C1 |
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| InChI Identifier | InChI=1S/C10H13NO4/c1-15-9-5-6(2-3-8(9)12)4-7(11)10(13)14/h2-3,5,7,12H,4,11H2,1H3,(H,13,14) |
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| InChI Key | PFDUUKDQEHURQC-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Description | belongs to the class of organic compounds known as tyrosine and derivatives. Tyrosine and derivatives are compounds containing tyrosine or a derivative thereof resulting from reaction of tyrosine 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 | Tyrosine and derivatives |
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| Alternative Parents | |
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| Substituents | - Tyrosine or derivatives
- Phenylalanine or derivatives
- 3-phenylpropanoic-acid
- Alpha-amino acid
- Amphetamine or derivatives
- Methoxyphenol
- Phenoxy compound
- Anisole
- Phenol ether
- Methoxybenzene
- Alkyl aryl ether
- 1-hydroxy-2-unsubstituted benzenoid
- Phenol
- Aralkylamine
- Benzenoid
- Monocyclic benzene moiety
- Amino acid
- Carboxylic acid
- Ether
- Monocarboxylic acid or derivatives
- Hydrocarbon derivative
- Primary aliphatic amine
- Organopnictogen compound
- Organonitrogen compound
- Organooxygen compound
- Carbonyl group
- Organic oxide
- Organic oxygen compound
- Primary amine
- Amine
- Organic nitrogen compound
- Aromatic homomonocyclic compound
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| Molecular Framework | Aromatic homomonocyclic compounds |
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| External Descriptors | |
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| Ontology |
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| Status | Expected but not 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 | Not Available |
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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 | 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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| Spectra |
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| Spectra | |
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