SEQ2FUN

BioLiP

PDB CCD ID: NT8
Number of entries in BioLiP: 2
Chemical formula: C10 H25 N O6 P2
InChI: InChI=1S/C10H25NO6P2/c1-2-3-4-5-6-7-8-9-10(11,18(12,13)14)19(15,16)17/h2-9,11H2,1H3,(H2,12,13,14)(H2,15,16,17)
InChIKey: TWYYYYAFACTHMV-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 2.0.4CCCCCCCCCC(N)(P(=O)(O)O)P(=O)(O)O
CACTVS 3.385CCCCCCCCCC(N)([P](O)(O)=O)[P](O)(O)=O
Name:(1-azanyl-1-phosphono-decyl)phosphonic acid
ChEMBL: CHEMBL5288063
ZINC: ZINC000100166436
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).