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Record Information |
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| Version |
1.0 |
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| Update Date |
1/22/2018 11:54:54 AM |
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Metabolite ID | PAMDB110624 |
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Identification |
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| Name: |
L-aspartyl-4-phosphate |
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| Description: | Dianionic form of 4-phosphonato-L-aspartic acid having carboxylic acid and phosphate functions in anionic form and a protonated nitrogen. |
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Structure |
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| Synonyms: | -
4-phospho-L-aspartate
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L-4-aspartyl phosphate
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L-β-aspartyl-P
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L-β-aspartyl-phosphate
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L-aspartyl-4-P
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L-aspartyl-β-phosphate
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4-phosphonato-L-aspartate
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Chemical Formula: |
C4H6NO7P
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| Average Molecular Weight: |
211.07 |
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| Monoisotopic Molecular
Weight: |
214.0116631588 |
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| InChI Key: |
IXZNKTPIYKDIGG-REOHCLBHSA-L |
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| InChI: |
InChI=1S/C4H8NO7P/c5-2(4(7)8)1-3(6)12-13(9,10)11/h2H,1,5H2,(H,7,8)(H2,9,10,11)/p-2/t2-/m0/s1 |
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| CAS
number: |
22138-53-0 |
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| IUPAC Name: | (2S)-2-azaniumyl-4-oxo-4-(phosphonatooxy)butanoate |
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Traditional IUPAC Name: |
aspartyl phosphate |
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| SMILES: | C(C([N+])C(=O)[O-])C(=O)OP([O-])(=O)[O-] |
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Chemical Taxonomy |
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Taxonomy Description | This compound belongs to the class of chemical entities known as aspartic acid and derivatives. These 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 |
Chemical entities |
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| Super Class | Organic compounds |
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Class |
Organic acids and derivatives |
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| Sub Class | Carboxylic acids and derivatives |
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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
- Alpha-amino acid
- Acyl monophosphate
- Acyl phosphate
- Dicarboxylic acid or derivatives
- Organic phosphoric acid derivative
- Fatty acid
- Carboxylic acid salt
- Amino acid
- Carboxylic acid
- Organic salt
- Primary amine
- Organooxygen compound
- Organonitrogen compound
- Organic oxide
- Primary aliphatic amine
- Organopnictogen compound
- Organic nitrogen compound
- Carbonyl group
- Amine
- Organic oxygen compound
- Hydrocarbon derivative
- Aliphatic acyclic compound
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| Molecular Framework |
Aliphatic acyclic compounds |
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| External Descriptors |
Not Available |
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Physical Properties |
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| State: |
Solid |
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| Charge: | -2 |
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Melting point: |
Not Available |
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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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Biological Properties |
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| Cellular Locations: |
Not Available |
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| Reactions: | |
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Pathways: |
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Spectra |
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| Spectra: |
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References |
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| References: |
Not Available |
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| Synthesis Reference: |
Not Available |
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| Material Safety Data Sheet (MSDS) |
Not Available |
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Links |
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| External Links: |
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