SEQ2FUN

BioLiP

PDB CCD ID: QD7
Number of entries in BioLiP: 2
Chemical formula: C4 H12 N O2 P
InChI: InChI=1S/C4H12NO2P/c1-8(6,7)4-2-3-5/h2-5H2,1H3,(H,6,7)
InChIKey: NHVRIDDXGZPJTJ-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
ACDLabs 12.01C(CCP(C)(O)=O)N
CACTVS 3.385C[P](O)(=O)CCCN
OpenEye OEToolkits 2.0.7CP(=O)(CCCN)O
Name:(R)-(3-aminopropyl)methylphosphinic acid
ChEMBL: CHEMBL112710
ZINC: ZINC000020028798
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).