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- ChemComp-AMQ: (S)-ALPHA-AMINO-3-HYDROXY-5-METHYL-4-ISOXAZOLEPROPIONIC ACID -

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Basic information

EntryDatabase: PDB chemical components / ID: AMQ
NameName: (S)-alpha-amino-3-hydroxy-5-methyl-4-isoxazolepropionic acid
Synonyms: AMPA
Commentneurotransmitter, agonist*YM

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Chemical information

Composition
Formula: C7H10N2O4 / Number of atoms: 23 / Formula weight: 186.165 / Formal charge: 0
Others

1ftm

Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: AMQ / Model coordinates PDB-ID: 1FTM
History
Create componentSep 27, 2000
Modify descriptorJun 4, 2011
Modify synonymsJun 5, 2020
External linksUniChem / ChemSpider / BindingDB / ChEMBL / ChemicalBook / DrugBank / Nikkaji / PubChem / PubChem_TPharma / SureChEMBL / ZINC / Wikipedia search / Google search

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Structure visualization

Structure viewerMolecule:
MolmilJmol/JSmol

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Details

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SMILES

ACDLabs 10.04O=C(O)C(N)Cc1c(onc1O)C
CACTVS 3.341Cc1onc(O)c1C[CH](N)C(O)=O
OpenEye OEToolkits 1.5.0Cc1c(c(no1)O)CC(C(=O)O)N

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SMILES CANONICAL

CACTVS 3.341Cc1onc(O)c1C[C@H](N)C(O)=O
OpenEye OEToolkits 1.5.0Cc1c(c(no1)O)C[C@@H](C(=O)O)N

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InChI

InChI 1.03InChI=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)/t5-/m0/s1

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InChIKey

InChI 1.03UUDAMDVQRQNNHZ-YFKPBYRVSA-N

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SYSTEMATIC NAME

ACDLabs 10.043-(3-hydroxy-5-methylisoxazol-4-yl)-L-alanine
OpenEye OEToolkits 1.5.0(2S)-2-amino-3-(3-hydroxy-5-methyl-1,2-oxazol-4-yl)propanoic acid

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