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BioLiP

PDB CCD ID: CUP
Number of entries in BioLiP: 1
Chemical formula: C16 H13 Cu N O3
InChI: InChI=1S/C16H15NO3.Cu/c18-15-9-5-4-8-13(15)11-17-14(16(19)20)10-12-6-2-1-3-7-12;/h1-9,11,14,18H,10H2,(H,19,20);/q;+2/p-2/b17-11+;/t14-;/m0./s1
InChIKey: YEXSLHMEGKWMMU-VNKRLIBXSA-L
SMILES:
SoftwareSMILES
OpenEye OEToolkits 2.0.7c1ccc(cc1)C[C@H]2C(=O)O[Cu]3[N]2=Cc4ccccc4O3
CACTVS 3.385O=C1O[Cu]Oc2ccccc2C=N[C@H]1Cc3ccccc3
OpenEye OEToolkits 2.0.7c1ccc(cc1)CC2C(=O)O[Cu]3[N]2=Cc4ccccc4O3
CACTVS 3.385O=C1O[Cu]Oc2ccccc2C=N[CH]1Cc3ccccc3
Name:(N-SALICYLIDEN-L-PHENYLALANATO)-COPPER(II)
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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