| Common Name |
L-Phosphoarginine
| Description |
L-Phosphoarginine is found in crustaceans. L-Phosphoarginine is a constituent of crayfish muscle.L-Phosphoarginine belongs to the family of Alpha Amino Acids and Derivatives. These are amino acids in which the amino group is attached to the carbon atom immediately adjacent to the carboxylate group (alpha carbon)[1]. (Reference: [1] Amino Acid: http://en.wikipedia.org/wiki/Amino_acid).
| Structure |
MOLSDFPDBSMILESInChI
Structure for HMDB29438 (L-Phosphoarginine)
| Synonyms |
| Value |
Source |
alpha-amino-delta-Phosphonoguanidinovaleric acidHMDB
Arginine phosphateHMDB
L-Arginine phosphateHMDB
L-Arginine-NG-phosphoric acidHMDB
N(5)-[imino(phosphonoamino)Methyl]-L-ornithineHMDB
N(Omega)-phospho-L-arginineHMDB
N(Omega)-phosphono-L-arginineHMDB
N-phospho-L-ArginineHMDB
N5-(imino(phosphonoamino)Methyl)L-ornithineHMDB
N5-[imino(phosphonoamino)Methyl]L-ornithineHMDB
Omega-N-phospho-L-arginineHMDB
Omega-N-phosphoarginineHMDB
phospho-L-ArginineHMDB
PhosphoarginineHMDB
| Chemical Formlia |
C6H15N4O5P
| Average Molecliar Weight |
254.1809
| Monoisotopic Molecliar Weight |
254.078006122
| IUPAC Name |
2-amino-5-(1-phosphonocarbamimidamido)pentanoic acid
| Traditional Name |
2-amino-5-(1-phosphonocarbamimidamido)pentanoic acid
| CAS Registry Number |
1189-11-3
| SMILES |
NC(CCCNC(=N)NP(O)(O)=O)C(O)=O
| InChI Identifier |
InChI=1S/C6H15N4O5P/c7-4(5(11)12)2-1-3-9-6(8)10-16(13,14)15/h4H,1-3,7H2,(H,11,12)(H5,8,9,10,13,14,15)
| InChI Key |
CCTIOCVIZPCTGO-UHFFFAOYSA-N
| Chemical Taxonomy |
| Classification |
Not classified
| Ontology |
| Status |
Expected but not Quantified
| Origin |
Endogenous
Food
| Biofunction |
Not Available
| Application |
Nutrient
| Cellliar locations |
Cytoplasm
Extracellliar
| Physical Properties |
| State |
Not Available
| Experimental Properties |
| Property |
Value |
Reference |
Melting Point175 – 180 °CNot Available
Boiling PointNot AvailableNot Available
Water SolubilityNot AvailableNot Available
LogPNot AvailableNot Available
| Predicted Properties |
| Property |
Value |
Source |
Water Solubility2.29 mg/mLALOGPS
logP-2.7ALOGPS
logP-5.2ChemAxon
logS-2ALOGPS
pKa (Strongest Acidic)-3ChemAxon
pKa (Strongest Basic)11.54ChemAxon
Physiological Charge-1ChemAxon
Hydrogen Acceptor Count8ChemAxon
Hydrogen Donor Count7ChemAxon
Polar Surface Area168.76 Å2ChemAxon
Rotatable Bond Count6ChemAxon
Refractivity65.09 m3·mol-1ChemAxon
Polarizability22.57 Å3ChemAxon
Number of Rings0ChemAxon
Bioavailability1ChemAxon
Rlie of FiveYesChemAxon
Ghose FilterYesChemAxon
Vebers RlieYesChemAxon
MDDR-like RlieYesChemAxon
| Spectra |
| Spectra |
| Spectrum Type |
Description |
Splash Key |
|
| Predicted LC-MS/MS |
Predicted LC-MS/MS Spectrum – 10V, Positivesplash10-0a4i-2490000000-c0291b7f6f651cb28f62View in MoNA
| Predicted LC-MS/MS |
Predicted LC-MS/MS Spectrum – 20V, Positivesplash10-05c6-5930000000-d666035c6ff221788b28View in MoNA
| Predicted LC-MS/MS |
Predicted LC-MS/MS Spectrum – 40V, Positivesplash10-00dl-9600000000-6ab90f13f27d25768ac2View in MoNA
| Predicted LC-MS/MS |
Predicted LC-MS/MS Spectrum – 10V, Negativesplash10-0udr-2590000000-85afd2716b2fc024e6a4View in MoNA
| Predicted LC-MS/MS |
Predicted LC-MS/MS Spectrum – 20V, Negativesplash10-002k-9520000000-cfee0bf9949c1374052fView in MoNA
| Predicted LC-MS/MS |
Predicted LC-MS/MS Spectrum – 40V, Negativesplash10-0092-9400000000-3c2355cf318c216a11a1View in MoNA
| Biological Properties |
| Cellliar Locations |
Cytoplasm
Extracellliar
| Biofluid Locations |
Not Available
| Tissue Location |
Not Available
| Pathways |
Not Available
| Normal Concentrations |
| Not Available |
| Abnormal Concentrations |
|
Not Available
| Associated Disorders and Diseases |
| Disease References |
None
| Associated OMIM IDs |
None
| External Links |
| DrugBank ID |
Not Available
| DrugBank Metabolite ID |
Not Available
| Phenol Explorer Compound ID |
Not Available
| Phenol Explorer Metabolite ID |
Not Available
| FoodDB ID |
FDB000543
| KNApSAcK ID |
Not Available
| Chemspider ID |
389451
| KEGG Compound ID |
C05945
| BioCyc ID |
Not Available
| BiGG ID |
Not Available
| Wikipedia Link |
Not Available
| NuGOwiki Link |
HMDB29438
| Metagene Link |
HMDB29438
| METLIN ID |
Not Available
| PubChem Compound |
440551
| PDB ID |
Not Available
| ChEBI ID |
18412
Product: MK-886
References |
| Synthesis Reference |
Not Available |
| Material Safety Data Sheet (MSDS) |
Not Available |
| General References |
- (). Yannai, Shmuel. (2004) Dictionary of food compounds with CD-ROM: Additives, flavors, and ingredients. Boca Raton: Chapman & Hall/CRC.. .
|
PMID: 2178909
