NXA

N-CARBOXYALANINE

Created:	2002-11-26
Last modified:	2024-09-27

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2 entries where NXA is found as a standalone ligand

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

2D diagram of NXA

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Chemical Component Summary
Name	N-CARBOXYALANINE
Systematic Name (OpenEye OEToolkits)	(2S)-2-(carboxyamino)propanoic acid
Formula	C₄ H₇ N O₄
Molecular Weight	133.103
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	10.04	O=C(O)C(NC(=O)O)C
SMILES	CACTVS	3.341	C[CH](NC(O)=O)C(O)=O
SMILES	OpenEye OEToolkits	1.5.0	CC(C(=O)O)NC(=O)O
Canonical SMILES	CACTVS	3.341	C[C@H](NC(O)=O)C(O)=O
Canonical SMILES	OpenEye OEToolkits	1.5.0	C[C@@H](C(=O)O)NC(=O)O
InChI	InChI	1.03	InChI=1S/C4H7NO4/c1-2(3(6)7)5-4(8)9/h2,5H,1H3,(H,6,7)(H,8,9)/t2-/m0/s1
InChIKey	InChI	1.03	JCVPWRQVQNVNGU-REOHCLBHSA-N

Related Resource References

Resource Name	Reference
PubChem	5496774

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