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2-amino-3-(3-hydroxy-5-methyl-1,2-oxazol-4-yl)(1,2-13C2)propanoic acid
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ChemBase ID:
160179
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Molecular Formular:
C7H10N2O4
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Molecular Mass:
189.14401857
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Monoisotopic Mass:
189.06780138
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SMILES and InChIs
SMILES:
c1(noc(c1C[13CH]([15NH2])[13C](=O)O)C)O
Canonical SMILES:
O[13C](=O)[13CH](Cc1c(C)onc1O)[15NH2]
InChI:
InChI=1S/C7H10N2O4/c1-3-4(6(10)9-13-3)2-5(8)7(11)12/h5H,2,8H2,1H3,(H,9,10)(H,11,12)/i5+1,7+1,8+1
InChIKey:
UUDAMDVQRQNNHZ-QIOHBQFSSA-N
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Cite this record
CBID:160179 http://www.chembase.cn/molecule-160179.html
NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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2-amino-3-(3-hydroxy-5-methyl-1,2-oxazol-4-yl)(1,2-13C2)propanoic acid
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IUPAC Traditional name
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2-amino-3-(3-hydroxy-5-methyl-1,2-oxazol-4-yl)(1,2-13C2)propanoic acid
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Synonyms
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D,L-α-Amino-3-hydroxy-5-methylisoxazole-4-propionic Acid-13C2,15N
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AMPA-13C2,15N
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γ-Amino-3-hydroxy-5-methylisoxazole-4-propionic Αcid-13C2,15N
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(R,S)-α-Amino-3-hydroxy-5-methyl-4-isoxazolepropionic Acid-13C2,15N
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DATA SOURCES
DATA SOURCES
All Sources Commercial Sources Non-commercial Sources
Data Source
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Data ID
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Price
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TRC
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CALCULATED PROPERTIES
CALCULATED PROPERTIES
JChem
Acid pKa
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1.5563054
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H Acceptors
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5
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H Donor
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3
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LogD (pH = 5.5)
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-2.4256098
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LogD (pH = 7.4)
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-3.4511206
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Log P
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-2.3328915
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Molar Refractivity
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44.0024 cm3
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Polarizability
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16.434475 Å3
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Polar Surface Area
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109.58 Å2
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Rotatable Bonds
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3
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Lipinski's Rule of Five
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true
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DETAILS
DETAILS
TRC
Toronto Research Chemicals -
A611502
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A potent and selective agonist of the putative, excitatory neurotransmitter L-glutamic acid. AMPA does not interfere with binding sites for kainic acid in vitro, and AMPA- induced neuronal excitation is not significantly affected by NMDA antagonists. |
REFERENCES
REFERENCES
From Suppliers
Google Scholar
PubMed
Google Books
- • Krogsgaard-Larsen, et al.: Nature, 284, 64 (1980)
- • Honore, T., et al.: J. Neurochem., 38, 173 (1980)
- • MacDonald, J.F., et al.: Science, 253, 1132 (1991)
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PATENTS
PATENTS
PubChem Patent
Google Patent