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BioLiP Library

PDB CCD ID: B3A
Number of entries in BioLiP: 0
Chemical formula: C4 H9 N O2
InChI: InChI=1S/C4H9NO2/c1-3(5)2-4(6)7/h3H,2,5H2,1H3,(H,6,7)/t3-/m0/s1
InChIKey: OQEBBZSWEGYTPG-VKHMYHEASA-N
SMILES:
SoftwareSMILES
CACTVS 3.341C[CH](N)CC(O)=O
CACTVS 3.341C[C@H](N)CC(O)=O
OpenEye OEToolkits 1.5.0C[C@@H](CC(=O)O)N
OpenEye OEToolkits 1.5.0CC(CC(=O)O)N
ACDLabs 10.04O=C(O)CC(N)C
Name:(3S)-3-AMINOBUTANOIC ACID
ZINC: ZINC000002034865
Reference:
  • Chengxin Zhang, Xi Zhang, Peter L Freddolino, and Yang Zhang. BioLiP2: an updated structure database for biologically relevent ligand-protein interactions, Nucleic Acids Research, gkad630 (2023)(download the PDF file).
  • Jianyi Yang, Ambrish Roy, and Yang Zhang. BioLiP: a semi-manually curated database for biologically relevant ligand-protein interactions, Nucleic Acids Research, 41: D1096-D1103 (2013) (download the PDF file).

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