| Record Information |
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| Version | 1.0 |
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| Creation Date | 2016-09-30 23:02:58 UTC |
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| Update Date | 2020-05-05 18:40:24 UTC |
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| BMDB ID | BMDB0003157 |
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| Secondary Accession Numbers | |
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| Metabolite Identification |
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| Common Name | Guanidinosuccinic acid |
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| Description | Guanidinosuccinic acid, also known as L-N-amidinoaspartic acid or N-amidino-L-aspartate, belongs to the class of organic compounds known as aspartic acid and derivatives. Aspartic acid and derivatives are compounds containing an aspartic acid or a derivative thereof resulting from reaction of aspartic acid 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 a small amount of articles have been published on Guanidinosuccinic acid. |
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| Structure | |
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| Synonyms | | Value | Source |
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| (2S)-2-Carbamimidamidobutanedioic acid | ChEBI | | L-N-Amidinoaspartic acid | ChEBI | | N-(Aminoiminomethyl)-L-aspartic acid | ChEBI | | N-Amidino-L-aspartic acid | Kegg | | (2S)-2-Carbamimidamidobutanedioate | Generator | | L-N-Amidinoaspartate | Generator | | N-(Aminoiminomethyl)-L-aspartate | Generator | | N-Amidino-L-aspartate | Generator | | Guanidinosuccinate | Generator | | N-Carbamimidoyl-L-aspartic acid | HMDB | | Guanidinosuccinic acid, (DL)-isomer | MeSH, HMDB | | Guanidinosuccinic acid | ChEBI |
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| Chemical Formula | C5H9N3O4 |
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| Average Molecular Weight | 175.1427 |
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| Monoisotopic Molecular Weight | 175.059305791 |
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| IUPAC Name | (2S)-2-carbamimidamidobutanedioic acid |
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| Traditional Name | N-amidino-L-aspartic acid |
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| CAS Registry Number | 6133-30-8 |
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| SMILES | NC(=N)N[C@@H](CC(O)=O)C(O)=O |
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| InChI Identifier | InChI=1S/C5H9N3O4/c6-5(7)8-2(4(11)12)1-3(9)10/h2H,1H2,(H,9,10)(H,11,12)(H4,6,7,8)/t2-/m0/s1 |
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| InChI Key | VVHOUVWJCQOYGG-REOHCLBHSA-N |
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| Chemical Taxonomy |
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| Description | belongs to the class of organic compounds known as aspartic acid and derivatives. Aspartic acid and derivatives are compounds containing an aspartic acid or a derivative thereof resulting from reaction of aspartic acid 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 | Aspartic acid and derivatives |
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| Alternative Parents | |
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| Substituents | - Aspartic acid or derivatives
- Dicarboxylic acid or derivatives
- Fatty acid
- Guanidine
- Organic 1,3-dipolar compound
- Propargyl-type 1,3-dipolar organic compound
- Carboximidamide
- Carboxylic acid
- Organopnictogen compound
- Hydrocarbon derivative
- Organic oxygen compound
- Organooxygen compound
- Organonitrogen compound
- Organic nitrogen compound
- Carbonyl group
- Organic oxide
- 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 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 | |
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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 | -2.068 | Not Available |
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| Predicted Properties | |
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| Spectra |
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| Spectra | |
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