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BioLiP

PDB CCD ID: LYW
Number of entries in BioLiP: 0
Chemical formula: C6 H13 N O
InChI: InChI=1S/C6H13NO/c1-2-3-4-6(7)5-8/h5-6H,2-4,7H2,1H3/t6-/m0/s1
InChIKey: TZJGKUCHNFFHGN-LURJTMIESA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 1.5.0CCCCC(C=O)N
OpenEye OEToolkits 1.5.0CCCC[C@@H](C=O)N
CACTVS 3.341CCCC[CH](N)C=O
CACTVS 3.341CCCC[C@H](N)C=O
ACDLabs 10.04O=CC(N)CCCC
Name:1-AMINO-1-CARBONYL PENTANE
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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