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BioLiP

PDB CCD ID: RTK
Number of entries in BioLiP: 1
Chemical formula: C6 H17 N O2 P
InChI: InChI=1S/C6H16NO2P/c1-7(2,3)5-4-6-10(8)9/h10H,4-6H2,1-3H3/p+1
InChIKey: WOSBPQBJRYGKCZ-UHFFFAOYSA-O
SMILES:
SoftwareSMILES
OpenEye OEToolkits 1.9.2C[N+](C)(C)CCCP(=O)O
CACTVS 3.385C[N+](C)(C)CCC[PH](O)=O
ACDLabs 12.01O=P(O)CCC[N+](C)(C)C
Name:trimethyl(3-oxidanylphosphonoylpropyl)azanium
ZINC: ZINC000098209378
Reference:
  • Chengxin Zhang, Xi Zhang, Peter L Freddolino, and Yang Zhang. BioLiP2: an updated structure database for biologically relevent ligand-protein interactions, Nucleic Acids Research, gkad630 (2023)(download the PDF file).
  • 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).

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