DBB

D-ALPHA-AMINOBUTYRIC ACID

Created:	2008-10-17
Last modified:	2024-09-27

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7 entries where DBB is found as a standalone ligand1 entries where DBB is covalently linked to polymer or other heterogen groups 47 entries where DBB is found in a polymer sequence

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Chemical Details
Formal Charge	0
Atom Count	16
Chiral Atom Count	1
Bond Count	15
Aromatic Bond Count	0

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Chemical Component Summary
Name	D-ALPHA-AMINOBUTYRIC ACID
Systematic Name (OpenEye OEToolkits)	(2R)-2-azanylbutanoic acid
Formula	C₄ H₉ N O₂
Molecular Weight	103.12
Type	D-PEPTIDE LINKING

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	O=C(O)C(N)CC
SMILES	CACTVS	3.385	CC[CH](N)C(O)=O
SMILES	OpenEye OEToolkits	1.7.6	CCC(C(=O)O)N
Canonical SMILES	CACTVS	3.385	CC[C@@H](N)C(O)=O
Canonical SMILES	OpenEye OEToolkits	1.7.6	CC[C@H](C(=O)O)N
InChI	InChI	1.03	InChI=1S/C4H9NO2/c1-2-3(5)4(6)7/h3H,2,5H2,1H3,(H,6,7)/t3-/m1/s1
InChIKey	InChI	1.03	QWCKQJZIFLGMSD-GSVOUGTGSA-N

Drug Info: DrugBank

DrugBank ID	DB04454
Name	Alpha-Aminobutyric Acid
Groups	experimental
Synonyms	Alpha-Aminobutyric Acid
Categories	Acids, Acyclic Amino Acids Amino Acids, Peptides, and Proteins Butyrates

Drug Targets

Name	Target Sequence	Pharmacological Action
Glycine amidinotransferase, mitochondrial	MLRVRCLRGGSRGAEAVHYIGSRLGRTLTGWVQRTFQSTQAATASSRNSC...	unknown
Gag-Pol polyprotein	MGARASVLSGGELDKWEKIRLRPGGKKKYKLKHIVWASRELERFAVNPGL...	unknown
Pro-epidermal growth factor	MLLTLIILLPVVSKFSFVSLSAPQHWSCPEGTLAGNGNSTCVGPAPFLIF...	unknown
Lantibiotic mersacidin	MSQEAIIRSWKDPFSRENSTQNPAGNPFSELKEAQMDKLVGAGDMEAACT...	unknown

Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS. Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682

Related Resource References

Resource Name	Reference
PubChem	6971251, 439691
ChEMBL	CHEMBL553426
ChEBI	CHEBI:28797
CCDC/CSD	TANCAO, GEJLEN, FITJAT, BERQAQ, DLABUT12, POVYEF, GEJCAA, BERNAN, HOSLOR, VEDZUC01
COD	7205608