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BioLiP

PDB CCD ID: YYH
Number of entries in BioLiP: 2
Chemical formula: C7 H14 O6
InChI: InChI=1S/C7H14O6/c1-2(8)6-4(10)3(9)5(11)7(12)13-6/h2-12H,1H3/t2-,3-,4-,5-,6+,7-/m0/s1
InChIKey: PZODEECXPHBZCU-QQABCQGCSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 1.7.6C[C@@H]([C@@H]1[C@H]([C@@H]([C@@H]([C@H](O1)O)O)O)O)O
CACTVS 3.370C[CH](O)[CH]1O[CH](O)[CH](O)[CH](O)[CH]1O
CACTVS 3.370C[C@H](O)[C@H]1O[C@H](O)[C@@H](O)[C@@H](O)[C@@H]1O
ACDLabs 12.01OC1C(O)C(OC(O)C1O)C(O)C
OpenEye OEToolkits 1.7.6CC(C1C(C(C(C(O1)O)O)O)O)O
Name:7-deoxy-L-glycero-alpha-D-manno-heptopyranose
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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