| Common Name |
L-Targinine
| Description |
L-Targinine is found in plises. L-Targinine is isolated from broad bean seedsL-Targinine 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 |
MOLSDF3D-SDFPDBSMILESInChI View 3D Structure
Structure for HMDB29416 (L-Targinine)
| Synonyms |
| Value |
Source |
Acide (2S)-2-amino-5-(3-methylguanidino)pentanoiqueChEBI
L-MonomethylarginineChEBI
L-NMMAChEBI
N-Monomethyl-L-arginineChEBI
N(5)-(methylamidino)-L-OrnithineChEBI
N(5)-(metilamidino)-L-OrnitinaChEBI
N(g)-Monomethyl-L-arginineChEBI
Ngamma-monomethyl-L-arginineChEBI
Omega-N-methylarginineChEBI
Omega-N-monomethylarginineChEBI
TargininaChEBI
TarginineChEBI
TargininumChEBI
TilargininaChEBI
TilarginineChEBI
TilargininumChEBI
N(5)-(N-Methylcarbamimidoyl)-L-ornithineHMDB
N(5)-[imino(methylamino)Methyl]-L-ornithineHMDB
N(Omega)-methyl-L-arginineHMDB
N-Methyl-L-arginineHMDB
N-Omega-methyl-L-arginineHMDB
N-Omega-monomethyl-L-arginineHMDB
N5-(N-Methylcarbamimidoyl)-L-ornithineHMDB
NG-Monomethyl-L-argineHMDB
L NG Monomethyl arginineMeSH
NG Monomethyl L arginineMeSH
Omega N methylarginineMeSH
Arginine, L-NG-monomethylMeSH
N(g)-MethylarginineMeSH
N(g)-Monomethyl-D-arginineMeSH
N(g)-MonomethylarginineMeSH
N(Omega)-monomethyl-L-arginineMeSH
D-NMMAMeSH
L MonomethylarginineMeSH
L-NG-Monomethyl arginineMeSH
NG-Monomethyl-L-arginineMeSH
| Chemical Formlia |
C7H16N4O2
| Average Molecliar Weight |
188.2275
| Monoisotopic Molecliar Weight |
188.127325776
| IUPAC Name |
(2S)-2-amino-5-(3-methylcarbamimidamido)pentanoic acid
| Traditional Name |
NG monomethyl L arginine
| CAS Registry Number |
17035-90-4
| SMILES |
CNC(=N)NCCC[C@H](N)C(O)=O
| InChI Identifier |
InChI=1S/C7H16N4O2/c1-10-7(9)11-4-2-3-5(8)6(12)13/h5H,2-4,8H2,1H3,(H,12,13)(H3,9,10,11)/t5-/m0/s1
| InChI Key |
NTNWOCRCBQPEKQ-YFKPBYRVSA-N
| Chemical Taxonomy |
| Description |
This compound belongs to the class of chemical entities known as arginine and derivatives. These are compounds containing arginine or a derivative thereof resliting from reaction of arginine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.
| Kingdom |
Chemical entities
| Super Class |
Organic compounds
| Class |
Organic acids and derivatives
| Sub Class |
Carboxylic acids and derivatives
| Direct Parent |
Arginine and derivatives
| Alternative Parents |
L-alpha-amino acids
Fatty acids and conjugates
Guanidines
Amino acids
Monocarboxylic acids and derivatives
Carboxylic acids
Carboximidamides
Organopnictogen compounds
Organic oxides
Monoalkylamines
Imines
Hydrocarbon derivatives
Carbonyl compounds
| Substituents |
Arginine or derivatives
Alpha-amino acid
L-alpha-amino acid
Fatty acid
Guanidine
Amino acid
Carboximidamide
Monocarboxylic acid or derivatives
Carboxylic acid
Hydrocarbon derivative
Organopnictogen compound
Organic oxygen compound
Primary amine
Organooxygen compound
Organonitrogen compound
Primary aliphatic amine
Imine
Carbonyl group
Amine
Organic nitrogen compound
Organic oxide
Aliphatic acyclic compound
| Molecliar Framework |
Aliphatic acyclic compounds
| External Descriptors |
guanidines (CHEBI:28229 )
non-proteinogenic L-alpha-amino acid (CHEBI:28229 )
L-arginine derivative (CHEBI:28229 )
| 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 PointNot AvailableNot Available
Boiling PointNot AvailableNot Available
Water SolubilityNot AvailableNot Available
LogPNot AvailableNot Available
| Predicted Properties |
| Property |
Value |
Source |
Water Solubility1.45 mg/mLALOGPS
logP-3.5ALOGPS
logP-2.9ChemAxon
logS-2.1ALOGPS
pKa (Strongest Acidic)2.48ChemAxon
pKa (Strongest Basic)12.64ChemAxon
Physiological Charge1ChemAxon
Hydrogen Acceptor Count6ChemAxon
Hydrogen Donor Count5ChemAxon
Polar Surface Area111.23 Å2ChemAxon
Rotatable Bond Count5ChemAxon
Refractivity58.7 m3·mol-1ChemAxon
Polarizability20.01 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, PositiveNot Available
| Predicted LC-MS/MS |
Predicted LC-MS/MS Spectrum – 20V, PositiveNot Available
| Predicted LC-MS/MS |
Predicted LC-MS/MS Spectrum – 40V, PositiveNot Available
| Predicted LC-MS/MS |
Predicted LC-MS/MS Spectrum – 10V, NegativeNot Available
| Predicted LC-MS/MS |
Predicted LC-MS/MS Spectrum – 20V, NegativeNot Available
| Predicted LC-MS/MS |
Predicted LC-MS/MS Spectrum – 40V, NegativeNot Available
| 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 |
FDB000510
| KNApSAcK ID |
Not Available
| Chemspider ID |
117259
| KEGG Compound ID |
C03884
| BioCyc ID |
Not Available
| BiGG ID |
Not Available
| Wikipedia Link |
Not Available
| NuGOwiki Link |
HMDB29416
| Metagene Link |
HMDB29416
| METLIN ID |
Not Available
| PubChem Compound |
132862
| PDB ID |
NMM
| ChEBI ID |
28229
Product: Lenampicillin (hydrochloride)
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: 21701689
