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BioLiP

PDB CCD ID: FVT
Number of entries in BioLiP: 1
Chemical formula: C5 H9 N O3
InChI: InChI=1S/C5H9NO3/c6-3-4(7)1-2-5(8)9/h1-3,6H2,(H,8,9)
InChIKey: ZGXJTSGNIOSYLO-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 2.0.6C(CC(=O)O)C(=O)CN
CACTVS 3.385NCC(=O)CCC(O)=O
Name:5-azanyl-4-oxidanylidene-pentanoic acid
ChEMBL: CHEMBL601
DrugBank: DB00855
ZINC: ZINC000003782550
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).
  • 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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