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BioLiP

PDB CCD ID: A5P
Number of entries in BioLiP: 36
Chemical formula: C5 H13 O8 P
InChI: InChI=1S/C5H13O8P/c6-1-3(7)5(9)4(8)2-13-14(10,11)12/h3-9H,1-2H2,(H2,10,11,12)/t3-,4-,5+/m1/s1
InChIKey: VJDOAZKNBQCAGE-WDCZJNDASA-N
SMILES:
SoftwareSMILES
CACTVS 3.341OC[C@@H](O)[C@H](O)[C@H](O)CO[P](O)(O)=O
OpenEye OEToolkits 1.5.0C(C(C(C(COP(=O)(O)O)O)O)O)O
CACTVS 3.341OC[CH](O)[CH](O)[CH](O)CO[P](O)(O)=O
ACDLabs 10.04O=P(O)(O)OCC(O)C(O)C(O)CO
OpenEye OEToolkits 1.5.0C([C@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O)O
Name:ARABINOSE-5-PHOSPHATE
DrugBank: DB03745
ZINC: ZINC000003871578
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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