SEQ2FUN

BioLiP

PDB CCD ID: C2Z
Number of entries in BioLiP: 6
Chemical formula: C7 H6 N O6 P
InChI: InChI=1S/C7H6NO6P/c9-6-3-4(8-14-6)5-1-2-7(13-5)15(10,11)12/h1-3,9H,(H2,10,11,12)
InChIKey: BRLJHMCTDKAUAY-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 1.9.2c1cc(oc1c2cc(on2)O)P(=O)(O)O
ACDLabs 12.01OP(c1ccc(o1)c2cc(O)on2)(O)=O
CACTVS 3.385Oc1onc(c1)c2oc(cc2)[P](O)(O)=O
Name:5-(5-hydroxyl-isoxazol-3-yl)-furan-2-phosphonic acid;
[5-(5-hydroxy-1,2-oxazol-3-yl)furan-2-yl]phosphonic acid
ChEMBL: CHEMBL1739997
ZINC: ZINC000066114329
Reference:
  • Chengxin Zhang, Xi Zhang, Lydia 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).