(S) -2-Allylglycine

CAT: 0957-E7388Size: 1 gDry Ice: NoHazardous: No

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CAT#:0957-E7388Size:1 g

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Description

(S) -2-Allylglycine (L-Allylglycine) is a potent inhibitor of glutamic acid decarboxylase (GAD), the key enzyme in GABA biosynthesis, causing GABA depletion, seizures, and neuronal damage. It is used in research on treatment-resistant seizures in epilepsy.

CAS Number

16338-48-0

Synonyms

L-Allylglycine

Target

Decarboxylase

Activity

Metabolism

Molecular Formula

C5H9NO2

Chemical Information

s-Allylglycine

L-allylglycine is the L-enantiomer of allylglycine. It is a GABA synthesis inhibitor. It has a role as an EC 4.1.1.15 (glutamate decarboxylase) inhibitor and a convulsant. It is an enantiomer of a D-allylglycine.

CAS Number	16338-48-0
PubChem CID	167529
IUPAC Name	(2S)-2-aminopent-4-enoic acid
Molecular Formula	C5H9NO2
Molecular Weight	115.13
XLogP	-2.3
Topological Polar Surface Area	63.3
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	3
Heavy Atom Count	8
Formal Charge	0
Complexity	101

SMILES

C=CC[C@@H](C(=O)O)N

InChI

InChI=1S/C5H9NO2/c1-2-3-4(6)5(7)8/h2,4H,1,3,6H2,(H,7,8)/t4-/m0/s1

InChIKey

WNNNWFKQCKFSDK-BYPYZUCNSA-N

Chemical Structure

2D Structure

CAS: 16338-48-0

CID: 167529

Formula: C5H9NO2

MW: 115.13

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	115.13
XLogP3	-2.3
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	3
Exact Mass	115.063328530
Monoisotopic Mass	115.063328530
Topological Polar Surface Area	63.3 Å²
Heavy Atom Count	8
Formal Charge	0
Complexity	101
Isotope Atom Count	0
Defined Atom Stereocenter Count	1
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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Alternative Products

Catalog	Name
C04095	(S) -2-Allylglycine
T25052-01	Allylglycine
261456-01	L-2-Allylglycine Hydrochloride
sc-472393	D-2-Allylglycine Hydrochloride
MBS3616690-01	L-Allylglycine
TRC-A556500-50MG	D-Allylglycine

(S) -2-Allylglycine

Chemical Information

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