A1IFH

(S)-amino-3-hydroxybutanoic acid

Created:	2024-06-21
Last modified:	2025-07-02

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2 entries where A1IFH is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	17
Chiral Atom Count	1
Bond Count	16
Aromatic Bond Count	0

2D diagram of A1IFH

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Chemical Component Summary
Name	(S)-amino-3-hydroxybutanoic acid
Synonyms	(S)-GABOB
Systematic Name (OpenEye OEToolkits)	(3~{S})-4-azanyl-3-oxidanyl-butanoic acid
Formula	C₄ H₉ N O₃
Molecular Weight	119.119
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.385	NC[CH](O)CC(O)=O
SMILES	OpenEye OEToolkits	2.0.7	C(C(CN)O)C(=O)O
Canonical SMILES	CACTVS	3.385	NC[C@@H](O)CC(O)=O
Canonical SMILES	OpenEye OEToolkits	2.0.7	C([C@@H](CN)O)C(=O)O
InChI	InChI	1.06	InChI=1S/C4H9NO3/c5-2-3(6)1-4(7)8/h3,6H,1-2,5H2,(H,7,8)/t3-/m0/s1
InChIKey	InChI	1.06	YQGDEPYYFWUPGO-VKHMYHEASA-N

RCSB PDB Core Operations are funded by the U.S. National Science Foundation (DBI-2321666), the US Department of Energy (DE-SC0019749), and the National Cancer Institute, National Institute of Allergy and Infectious Diseases, and National Institute of General Medical Sciences of the National Institutes of Health under grant R01GM157729.