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BioLiP

PDB CCD ID: FM4
Number of entries in BioLiP: 1
Chemical formula: C3 H8 O7 P2
InChI: InChI=1S/C3H8O7P2/c1-2-3(9-2)11(4,5)10-12(6,7)8/h2-3H,1H3,(H,4,5)(H2,6,7,8)/t2-,3+/m0/s1
InChIKey: WODGUJUDEVOKET-STHAYSLISA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 1.7.0CC1C(O1)P(=O)(O)OP(=O)(O)O
OpenEye OEToolkits 1.7.0C[C@H]1[C@H](O1)[P@@](=O)(O)OP(=O)(O)O
CACTVS 3.370C[C@@H]1O[C@@H]1[P](O)(=O)O[P](O)(O)=O
CACTVS 3.370C[CH]1O[CH]1[P](O)(=O)O[P](O)(O)=O
Name:[(2R,3S)-3-methyloxiran-2-yl]-phosphonooxy-phosphinic acid
ZINC: ZINC000039169775
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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