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BioLiP

PDB CCD ID: HSK
Number of entries in BioLiP: 0
Chemical formula: C6 H9 N3 O3
InChI: InChI=1S/C6H9N3O3/c7-5(6(10)11)1-4-2-8-3-9(4)12/h2-3,5,12H,1,7H2,(H,10,11)/t5-/m0/s1
InChIKey: MPVGZUDRATZEEE-YFKPBYRVSA-N
SMILES:
SoftwareSMILES
ACDLabs 12.01O=C(O)C(N)Cc1cncn1O
OpenEye OEToolkits 1.7.6c1c(n(cn1)O)C[C@@H](C(=O)O)N
OpenEye OEToolkits 1.7.6c1c(n(cn1)O)CC(C(=O)O)N
CACTVS 3.385N[CH](Cc1cncn1O)C(O)=O
CACTVS 3.385N[C@@H](Cc1cncn1O)C(O)=O
Name:3-hydroxy-L-histidine
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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