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BioLiP

PDB CCD ID: LIS
Number of entries in BioLiP: 0
Chemical formula: C5 H9 N O3
InChI: InChI=1S/C5H9NO3/c6-4(5(7)8)1-3-2-9-3/h3-4H,1-2,6H2,(H,7,8)/t3-,4-/m0/s1
InChIKey: HKPCHCJYQVJLIZ-IMJSIDKUSA-N
SMILES:
SoftwareSMILES
ACDLabs 10.04O=C(O)C(N)CC1OC1
OpenEye OEToolkits 1.5.0C1[C@@H](O1)C[C@@H](C(=O)O)N
CACTVS 3.341N[CH](C[CH]1CO1)C(O)=O
CACTVS 3.341N[C@@H](C[C@H]1CO1)C(O)=O
OpenEye OEToolkits 1.5.0C1C(O1)CC(C(=O)O)N
Name:(2S,4S)-2-AMINO-4,5-EPOXIPENTANOIC ACID;
3-OXIRAN-2YLALANINE
DrugBank: DB03191
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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