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BioLiP Library

PDB CCD ID: BOR
Number of entries in BioLiP: 0
Chemical formula: C5 H15 B N4 O2
InChI: InChI=1S/C5H15BN4O2/c7-4(6(11)12)2-1-3-10-5(8)9/h4,11-12H,1-3,7H2,(H4,8,9,10)/t4-/m0/s1
InChIKey: ACTXPNAHMKBUTO-BYPYZUCNSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 1.7.0B(C(CCCNC(=N)N)N)(O)O
ACDLabs 12.01OB(O)C(N)CCCNC(=[N@H])N
CACTVS 3.370N[C@@H](CCCNC(N)=N)B(O)O
CACTVS 3.370N[CH](CCCNC(N)=N)B(O)O
OpenEye OEToolkits 1.7.0B([C@H](CCCNC(=N)N)N)(O)O
Name:(1R)-1-AMINO-4-{[(E)-AMINO(IMINO)METHYL]AMINO}BUTYLBORONIC ACID;
BORO ARGININE
ChEMBL: CHEMBL1231428
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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