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BioLiP

PDB CCD ID: 4AX
Number of entries in BioLiP: 3
Chemical formula: C3 H6 N2 O2
InChI: InChI=1S/C3H6N2O2/c4-2-1-7-5-3(2)6/h2H,1,4H2,(H,5,6)/t2-/m1/s1
InChIKey: DYDCUQKUCUHJBH-UWTATZPHSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 1.5.0C1C(C(=O)NO1)N
ACDLabs 10.04O=C1NOCC1N
CACTVS 3.341N[C@@H]1CONC1=O
OpenEye OEToolkits 1.5.0C1[C@H](C(=O)NO1)N
CACTVS 3.341N[CH]1CONC1=O
Name:(R)-4-AMINO-ISOXAZOLIDIN-3-ONE
ChEMBL: CHEMBL771
DrugBank: DB00260
ZINC: ZINC000034676245
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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