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BioLiP Library

PDB CCD ID: AGM
Number of entries in BioLiP: 0
Chemical formula: C7 H17 N4 O2
InChI: InChI=1S/C7H16N4O2/c1-4(11-7(9)10)2-3-5(8)6(12)13/h4-5H,2-3,8H2,1H3,(H,12,13)(H4,9,10,11)/p+1/t4-,5-/m0/s1
InChIKey: AATIXZODJZMQQA-WHFBIAKZSA-O
SMILES:
SoftwareSMILES
CACTVS 3.341C[C@@H](CC[C@H](N)C(O)=O)NC(N)=[NH2+]
OpenEye OEToolkits 1.5.0C[C@@H](CC[C@@H](C(=O)O)N)NC(=[NH2+])N
OpenEye OEToolkits 1.5.0CC(CCC(C(=O)O)N)NC(=[NH2+])N
CACTVS 3.341C[CH](CC[CH](N)C(O)=O)NC(N)=[NH2+]
ACDLabs 10.04O=C(O)C(N)CCC(N\C(=[NH2+])N)C
Name:5-METHYL-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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