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BioLiP Library

PDB CCD ID: CV2
Number of entries in BioLiP: 2
Chemical formula: C9 H12 N O3 P
InChI: InChI=1S/C9H12NO3P/c1-7(9(10)14(11,12)13)8-5-3-2-4-6-8/h2-6,9H,1,10H2,(H2,11,12,13)/t9-/m0/s1
InChIKey: JUVPNYIYKLIRHO-VIFPVBQESA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 2.0.6C=C(c1ccccc1)[C@@H](N)P(=O)(O)O
CACTVS 3.385N[CH](C(=C)c1ccccc1)[P](O)(O)=O
OpenEye OEToolkits 2.0.6C=C(c1ccccc1)C(N)P(=O)(O)O
CACTVS 3.385N[C@H](C(=C)c1ccccc1)[P](O)(O)=O
Name:(S)-(1-amino-2phenylallyl)phosphonic acid
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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