Record Information |
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Version | 1.0 |
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Creation date | 2015-10-09 22:33:32 UTC |
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Update date | 2017-01-19 02:36:42 UTC |
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FoodComEx ID | PC000943 |
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FoodDB Record | FDB001089 |
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Chemical Information |
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Name | (S)-N-Acetylmethionine |
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Description | Nutrient supplement used as a source of L-methionine. |
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CAS Number | 65-82-7 |
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Structure | |
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Synonyms | Synonym | Source |
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Acetyl-L-Methionine | biospider | Acetylmethionin | HMDB | Acetylmethionine | biospider | DL-N-Acetylmethionine | HMDB | L-(N-Acetyl)methionine | biospider | L-Methionine, N-acetyl- | biospider | L-N-Acetyl-methionine | biospider | Methionamine | biospider | Methionin | HMDB | Methionine, N-acetyl- | biospider | Methionine, N-acetyl-, L- (8CI) | biospider | N-Acetyl-L-methionine | biospider | N-Acetyl-methionine | biospider | N-Acetyl-S-methylhomocysteine | biospider | N-Acetyl(methyl)homocysteine | HMDB | N-Acetylmethionine | biospider | Thiomedon | HMDB |
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Chemical Formula | C7H13NO3S |
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IUPAC name | (2S)-2-acetamido-4-(methylsulfanyl)butanoic acid |
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InChI Identifier | InChI=1S/C7H13NO3S/c1-5(9)8-6(7(10)11)3-4-12-2/h6H,3-4H2,1-2H3,(H,8,9)(H,10,11)/t6-/m0/s1 |
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InChI Key | XUYPXLNMDZIRQH-LURJTMIESA-N |
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Isomeric SMILES | [H][C@@](CCSC)(NC(C)=O)C(O)=O |
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Average Molecular Weight | 191.248 |
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Monoisotopic Molecular Weight | 191.061613977 |
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Chemical Taxonomy |
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Description | Belongs to the class of organic compounds known as methionine and derivatives. Methionine and derivatives are compounds containing methionine or a derivative thereof resulting from reaction of methionine 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 | Methionine and derivatives |
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Alternative Parents | |
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Substituents | - Methionine or derivatives
- N-acyl-alpha-amino acid
- N-acyl-alpha amino acid or derivatives
- N-acyl-l-alpha-amino acid
- Thia fatty acid
- Fatty acid
- Fatty acyl
- Acetamide
- Secondary carboxylic acid amide
- Carboxamide group
- Dialkylthioether
- Sulfenyl compound
- Thioether
- Monocarboxylic acid or derivatives
- Carboxylic acid
- Hydrocarbon derivative
- Organic oxygen compound
- Organosulfur compound
- Organooxygen compound
- Organonitrogen compound
- Carbonyl group
- Organic oxide
- Organopnictogen compound
- Organic nitrogen compound
- Aliphatic acyclic compound
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Molecular Framework | Aliphatic acyclic compounds |
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External Descriptors | |
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Physico-Chemical Properties - Experimental |
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Property | Value | Reference |
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Experimental logP | -0.03 | MEYLAN,WM & HOWARD,PH (1995) |
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Experimental Water Solubility | 307 mg/mL at 25 oC | BEILSTEIN |
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Melting Point | Mp 104° | DFC |
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Foods of Origin |
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Food | Content Range | Average | Reference |
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Food | | | Reference |
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Production Data |
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Production Method | commercial |
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Production Method Reference | Not Available |
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Production Method Reference File | Not Available |
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Quantity Available | Production upon request, up to 3 g |
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Delivery Time | Not Available |
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Storage Form | solid |
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Storage Conditions | -80°C |
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Stability | Not Available |
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Purity | Not Available |
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Spectra |
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Spectral Data Upon Request | Not Available |
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Provider Information |
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Commercial Vendors |
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AKSci | F966 |
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AKSci | J92115 |
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Glentham | GM6577 |
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MetaSci | HMDB0011745 |
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Sigma-Aldrich | HMDB0011745 |
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