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BioLiP

PDB CCD ID: AOR
Number of entries in BioLiP: 1
Chemical formula: C7 H14 N2 O3
InChI: InChI=1S/C7H14N2O3/c1-5(10)9-6(7(11)12)3-2-4-8/h6H,2-4,8H2,1H3,(H,9,10)(H,11,12)/t6-/m0/s1
InChIKey: JRLGPAXAGHMNOL-LURJTMIESA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 1.5.0CC(=O)N[C@@H](CCCN)C(=O)O
CACTVS 3.341CC(=O)N[CH](CCCN)C(O)=O
OpenEye OEToolkits 1.5.0CC(=O)NC(CCCN)C(=O)O
ACDLabs 10.04O=C(NC(C(=O)O)CCCN)C
CACTVS 3.341CC(=O)N[C@@H](CCCN)C(O)=O
Name:N~2~-ACETYL-L-ORNITHINE
ZINC: ZINC000001532657
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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