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BioLiP

PDB CCD ID: 3ZL
Number of entries in BioLiP: 0
Chemical formula: C11 H19 N3 O3
InChI: InChI=1S/C11H19N3O3/c1-8(12)10(15)5-7-14-6-3-2-4-9(13)11(16)17/h5,7,9,14H,1-4,6,12-13H2,(H,16,17)/b7-5-/t9-/m0/s1
InChIKey: HDSUFAZLYUUHFR-PGBBXKAQSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 1.9.2C=C(C(=O)C=CNCCCCC(C(=O)O)N)N
OpenEye OEToolkits 1.9.2C=C(C(=O)/C=C\NCCCC[C@@H](C(=O)O)N)N
ACDLabs 12.01O=C(O)C(N)CCCCN/C=C\C(=O)C(=C)/N
CACTVS 3.385N[C@@H](CCCCN\C=C/C(=O)C(N)=C)C(O)=O
CACTVS 3.385N[CH](CCCCNC=CC(=O)C(N)=C)C(O)=O
Name:N~6~-[(1Z)-4-amino-3-oxopenta-1,4-dien-1-yl]-L-lysine
ZINC: ZINC000263620500
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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