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2-amino-3-(1H-pyrazol-1-yl)propanoic acid

PubChem CID: 119630

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Compound Synonyms 28024-60-4, 2-amino-3-(1H-pyrazol-1-yl)propanoic acid, 2-AMINO-3-PYRAZOL-1-YL-PROPIONIC ACID, Pyrazole-1-alanine, 2-amino-3-pyrazol-1-ylpropanoic acid, 2-Amino-3-(1-pyrazolyl)propanoic Acid, 3-(1-Pyrazolyl)-alanine, (+/-)-alpha-amino-1H-pyrazole-1-propionic acid, 1-pyrazolylalanine, EINECS 248-785-0, (R)-2-Amino-3-pyrazol-1-yl-propionicacid, MFCD09832221, 2-amino-3-pyrazol-1-yl-propanoic acid, (1)-alpha-Amino-1H-pyrazole-1-propionic acid, SCHEMBL4153679, 3-(Pyrazol-1-yl)-DL-alanine, DTXSID60901786, CHEBI:165849, PIGOPELHGLPKLL-UHFFFAOYSA-N, DBA02460, AC5797, AKOS009235513, SB36358, SY026507, L-2-Amino-3-(1-pyrazolyl)propanoic acid, 2-amino-3-(1H-pyrazol-1-yl)propanoicacid, DB-067865, propanoic acid, 2-amino-3-(1-pyrazolyl)-, alpha-Amino-beta-(pyrazolyl-N)propionic acid, NS00049266, EN300-147175, Z2933867195, ( inverted exclamation markA)-alpha-amino-1H-pyrazole-1-propionic acid
Topological Polar Surface Area 81.1
Hydrogen Bond Donor Count 2.0
Heavy Atom Count 11.0
Description Amino acid present in seeds of Citrullus vulgaris (watermelon). L-2-Amino-3-(1-pyrazolyl)propanoic acid is found in fruits.
Isotope Atom Count 0.0
Molecular Complexity 151.0
Database Name fooddb_chem_all;hmdb_chem_all;npass_chem_all;pubchem
Defined Atom Stereocenter Count 0.0
Iupac Name 2-amino-3-pyrazol-1-ylpropanoic acid
Nih Violation False
Class Carboxylic acids and derivatives
Xlogp -3.4
Superclass Organic acids and derivatives
Is Pains False
Subclass Amino acids, peptides, and analogues
Molecular Formula C6H9N3O2
Inchi Key PIGOPELHGLPKLL-UHFFFAOYSA-N
Rotatable Bond Count 3.0
State Solid
Synonyms 2-Amino-3-(1-pyrazolyl)propanoic acid, L-form, alpha-Amino-beta-(pyrazolyl-N)propionic acid, L-2-Amino-3-(1-pyrazolyl)propanoate, beta-(Pyrazole-1-yl)-L-alanine, beta-Pyrazol-1-ylalanine, alpha-Amino-1H-pyrazole-1-propanoic acid, Pyrazole-1-alanine, beta-(Pyrazole-1-yl)-ala, beta-Pyrazol-1-ylalanine, (+,-)-isomer, beta-Pyrazol-1-ylalanine, (S)-isomer, alpha-amino-beta-(Pyrazolyl-N)propionic acid, 2-Amino-3-(1H-pyrazol-1-yl)propanoate
Compound Name 2-amino-3-(1H-pyrazol-1-yl)propanoic acid
Kingdom Organic compounds
Exact Mass 155.069
Formal Charge 0.0
Brenk Violation False
Monoisotopic Mass 155.069
Hydrogen Bond Acceptor Count 4.0
Molecular Weight 155.15
Covalent Unit Count 1.0
Total Atom Stereocenter Count 1.0
Total Bond Stereocenter Count 0.0
Molecular Framework Aromatic heteromonocyclic compounds
Inchi InChI=1S/C6H9N3O2/c7-5(6(10)11)4-9-3-1-2-8-9/h1-3,5H,4,7H2,(H,10,11)
Smiles C1=CN(N=C1)CC(C(=O)O)N
Defined Bond Stereocenter Count 0.0
Taxonomy Direct Parent Alpha amino acids