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BioLiP

PDB CCD ID: 1PT
Number of entries in BioLiP: 3
Chemical formula: C6 H14 N2 Pt
InChI: InChI=1S/C6H14N2.Pt/c7-5-3-1-2-4-6(5)8;/h5-6H,1-4,7-8H2;/q;+2/t5-,6-;/m1./s1
InChIKey: SGLJYTWMWIAGEU-KGZKBUQUSA-N
SMILES:
SoftwareSMILES
ACDLabs 12.01[Pt+2]1NC2C(N1)CCCC2
OpenEye OEToolkits 1.7.6C1CCC2C(C1)[NH2][Pt+2][NH2]2
CACTVS 3.385[Pt++]|1|N[CH]2CCCC[CH]2N|1
CACTVS 3.385[Pt++]|1|N[C@@H]2CCCC[C@H]2N|1
OpenEye OEToolkits 1.7.6C1CC[C@@H]2[C@@H](C1)[NH2][Pt+2][NH2]2
Name:CYCLOHEXANE-1(R),2(R)-DIAMINE-PLATINUM(II);
OXALIPLATIN

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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