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BioLiP

PDB CCD ID: G7P
Number of entries in BioLiP: 1
Chemical formula: C7 H15 O8 P
InChI: InChI=1S/C7H15O8P/c8-4-3(1-2-16(12,13)14)15-7(11)6(10)5(4)9/h3-11H,1-2H2,(H2,12,13,14)/t3-,4-,5+,6-,7-/m1/s1
InChIKey: POGBMBNNYPHAGN-XUUWZHRGSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 1.6.1C(CP(=O)(O)O)C1C(C(C(C(O1)O)O)O)O
CACTVS 3.352O[CH]1O[CH](CC[P](O)(O)=O)[CH](O)[CH](O)[CH]1O
OpenEye OEToolkits 1.6.1C(CP(=O)(O)O)[C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)O)O)O)O
ACDLabs 10.04O=P(O)(O)CCC1OC(O)C(O)C(O)C1O
CACTVS 3.352O[C@@H]1O[C@H](CC[P](O)(O)=O)[C@@H](O)[C@H](O)[C@H]1O
Name:6,7-dideoxy-7-phosphono-beta-D-gluco-heptopyranose;
6,7-dideoxy-7-phosphono-beta-D-gluco-heptose;
6,7-dideoxy-7-phosphono-D-gluco-heptose;
6,7-dideoxy-7-phosphono-gluco-heptose
ZINC: ZINC000039129324
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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