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BioLiP

PDB CCD ID: RCY
Number of entries in BioLiP: 9
Chemical formula: C12 H19 N2 O3
InChI: InChI=1S/C12H20N2O3/c1-11(2)7-8(12(3,4)14(11)17)13-9(15)5-6-10(13)16/h8,17H,5-7H2,1-4H3/t8-/m1/s1
InChIKey: BGLGHMPQDJUKJG-MRVPVSSYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 1.7.6CC1(CC(C(N1[O])(C)C)N2C(=O)CCC2=O)C
CACTVS 3.370CC1(C)C[C@@H](N2C(=O)CCC2=O)C(C)(C)N1[O]
ACDLabs 12.01ON2C(CC(N1C(=O)CCC1=O)C2(C)C)(C)C
CACTVS 3.370CC1(C)C[CH](N2C(=O)CCC2=O)C(C)(C)N1[O]
OpenEye OEToolkits 1.7.6CC1(C[C@H](C(N1[O])(C)C)N2C(=O)CCC2=O)C
Name:(3'R)-1'-oxyl-2',2',5',5'-tetramethyl-1,3'-bipyrrolidine-2,5-dione;
3-Maleimido-PROXYL (bound form)
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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