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BioLiP Library

PDB CCD ID: ARO
Number of entries in BioLiP: 0
Chemical formula: C6 H15 N4 O3
InChI: InChI=1S/C6H14N4O3/c7-4(5(12)13)1-3(11)2-10-6(8)9/h3-4,11H,1-2,7H2,(H,12,13)(H4,8,9,10)/p+1/t3-,4+/m1/s1
InChIKey: OPCBKDJCJYBGTQ-DMTCNVIQSA-O
SMILES:
SoftwareSMILES
OpenEye OEToolkits 1.5.0C(C(CNC(=[NH2+])N)O)C(C(=O)O)N
OpenEye OEToolkits 1.5.0C([C@H](CNC(=[NH2+])N)O)[C@@H](C(=O)O)N
CACTVS 3.341N[CH](C[CH](O)CNC(N)=[NH2+])C(O)=O
ACDLabs 10.04O=C(O)C(N)CC(O)CNC(\N)=[NH2+]
CACTVS 3.341N[C@@H](C[C@@H](O)CNC(N)=[NH2+])C(O)=O
Name:C-GAMMA-HYDROXY ARGININE
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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