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BioLiP

PDB CCD ID: NLP
Number of entries in BioLiP: 9
Chemical formula: C5 H14 N O3 P
InChI: InChI=1S/C5H14NO3P/c1-2-3-4-5(6)10(7,8)9/h5H,2-4,6H2,1H3,(H2,7,8,9)/t5-/m1/s1
InChIKey: NXTPDFMZKSLVRK-RXMQYKEDSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 1.5.0CCCC[C@H](N)P(=O)(O)O
CACTVS 3.341CCCC[C@H](N)[P](O)(O)=O
OpenEye OEToolkits 1.5.0CCCCC(N)P(=O)(O)O
CACTVS 3.341CCCC[CH](N)[P](O)(O)=O
ACDLabs 10.04O=P(O)(O)C(N)CCCC
Name:(1-AMINO-PENTYL)-PHOSPHONIC ACID;
NORLEUCINE PHOSPHONATE
DrugBank: DB02088
ZINC: ZINC000002047313
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).
  • 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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