SEQ2FUN

BioLiP

PDB CCD ID: DZA
Number of entries in BioLiP: 5
Chemical formula: C6 H12 N2 O3
InChI: InChI=1S/C6H12N2O3/c1-8(2)7-5(9)3-4-6(10)11/h3-4H2,1-2H3,(H,7,9)(H,10,11)
InChIKey: NOQGZXFMHARMLW-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 1.9.2CN(C)NC(=O)CCC(=O)O
CACTVS 3.385CN(C)NC(=O)CCC(O)=O
ACDLabs 12.01O=C(NN(C)C)CCC(=O)O
Name:DAMINOZIDE
ChEMBL: CHEMBL2164243
ZINC: ZINC000001532111
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).