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Kainic acid

CAT: 0063-58606205-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0063-58606205-01Size:10 mg
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CAS Number
487-79-6

Chemical Information

alpha-Kainic acid

Kainic acid is a dicarboxylic acid, a pyrrolidinecarboxylic acid, a non-proteinogenic L-alpha-amino acid and a L-proline derivative. It has a role as an antinematodal drug and an excitatory amino acid agonist. It is a conjugate acid of a kainate(1-).

CAS Number487-79-6
PubChem CID10255
IUPAC Name(2S,3S,4S)-3-(carboxymethyl)-4-prop-1-en-2-ylpyrrolidine-2-carboxylic acid
Molecular FormulaC10H15NO4
Molecular Weight213.23
XLogP-1.8
Topological Polar Surface Area86.6
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Heavy Atom Count15
Formal Charge0
Complexity300
SMILES
CC(=C)[C@H]1CN[C@@H]([C@H]1CC(=O)O)C(=O)O
InChI
InChI=1S/C10H15NO4/c1-5(2)7-4-11-9(10(14)15)6(7)3-8(12)13/h6-7,9,11H,1,3-4H2,2H3,(H,12,13)(H,14,15)/t6-,7+,9-/m0/s1
InChIKey
VLSMHEGGTFMBBZ-OOZYFLPDSA-N
Chemical Structure
2D Structure
2D structure of alpha-Kainic acid
CAS: 487-79-6
CID: 10255
Formula: C10H15NO4
MW: 213.23
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight213.23
XLogP3-1.8
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Exact Mass213.10010796
Monoisotopic Mass213.10010796
Topological Polar Surface Area86.6 Ų
Heavy Atom Count15
Formal Charge0
Complexity300
Isotope Atom Count0
Defined Atom Stereocenter Count3
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
TRC-K135010-50MG(-)-a-Kainic Acid
abx076647-01Kainic acid
FR27527-01(+/-) -Kainic acid
167180(-) -α-Kainic Acid

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