SEQ2FUN

BioLiP

PDB CCD ID: AH8
Number of entries in BioLiP: 4
Chemical formula: C5 H9 N3 O4
InChI: InChI=1S/C5H9N3O4/c6-8-7-5-4(11)3(10)2(1-9)12-5/h2-5,9-11H,1H2/t2-,3-,4+,5+/m0/s1
InChIKey: DHFFHQUOZLQWBU-QMKXCQHVSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 1.7.0C(C1C(C(C(O1)N=[N+]=[N-])O)O)O
ACDLabs 12.01[N-]=[N+]=N/C1OC(C(O)C1O)CO
OpenEye OEToolkits 1.7.0C([C@H]1[C@@H]([C@H]([C@@H](O1)N=[N+]=[N-])O)O)O
CACTVS 3.370OC[CH]1O[CH](N=[N+]=[N-])[CH](O)[CH]1O
CACTVS 3.370OC[C@@H]1O[C@@H](N=[N+]=[N-])[C@H](O)[C@H]1O
Name:(2R,3R,4R,5S)-2-azido-5-(hydroxymethyl)oxolane-3,4-diol;
(2R,3R,4R,5S)-2-azido-5-(hydroxymethyl)tetrahydrofuran-3,4-diol
ChEMBL: CHEMBL1230883

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).