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BioLiP

PDB CCD ID: 13P
Number of entries in BioLiP: 1
Chemical formula: C3 H7 O6 P
InChI: InChI=1S/C3H7O6P/c4-1-3(5)2-9-10(6,7)8/h4H,1-2H2,(H2,6,7,8)
InChIKey: GNGACRATGGDKBX-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
ACDLabs 10.04O=P(O)(O)OCC(=O)CO
CACTVS 3.341OCC(=O)CO[P](O)(O)=O
OpenEye OEToolkits 1.5.0C(C(=O)COP(=O)(O)O)O
Name:1,3-DIHYDROXYACETONEPHOSPHATE
ChEMBL: CHEMBL1161998
DrugBank: DB04326
ZINC: ZINC000024492326
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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