2RA

3-amino-D-alanine

Created:	2010-09-27
Last modified:	2024-09-27

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2 entries where 2RA is found as a standalone ligand1 entries where 2RA is covalently linked to polymer or other heterogen groups 7 entries where 2RA is found in a polymer sequence

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Chemical Details
Formal Charge	0
Atom Count	15
Chiral Atom Count	1
Bond Count	14
Aromatic Bond Count	0

2D diagram of 2RA

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Chemical Component Summary
Name	3-amino-D-alanine
Synonyms	diaminopropanoic acid
Systematic Name (OpenEye OEToolkits)	(2R)-2,3-bis(azanyl)propanoic acid
Formula	C₃ H₈ N₂ O₂
Molecular Weight	104.108
Type	D-PEPTIDE LINKING

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	O=C(O)C(N)CN
SMILES	CACTVS	3.385	NC[CH](N)C(O)=O
SMILES	OpenEye OEToolkits	1.7.6	C(C(C(=O)O)N)N
Canonical SMILES	CACTVS	3.385	NC[C@@H](N)C(O)=O
Canonical SMILES	OpenEye OEToolkits	1.7.6	C([C@H](C(=O)O)N)N
InChI	InChI	1.03	InChI=1S/C3H8N2O2/c4-1-2(5)3(6)7/h2H,1,4-5H2,(H,6,7)/t2-/m1/s1
InChIKey	InChI	1.03	PECYZEOJVXMISF-UWTATZPHSA-N

Related Resource References

Resource Name	Reference
PubChem	638152, 90657712
ChEMBL	CHEMBL420464
ChEBI	CHEBI:136599, CHEBI:136598
CCDC/CSD	XOHPAO

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