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BioLiP

PDB CCD ID: W9T
Number of entries in BioLiP: 0
Chemical formula: C12 H22 O11
InChI: InChI=1S/C12H22O11/c13-1-4-6(16)7(17)8(18)11(21-4)22-9-5(2-14)23-12(20,3-15)10(9)19/h4-11,13-20H,1-3H2/t4-,5-,6+,7+,8-,9-,10+,11+,12-/m1/s1
InChIKey: JCQLYHFGKNRPGE-FCVZTGTOSA-N
SMILES:
SoftwareSMILES
CACTVS 3.370OC[CH]1O[CH](O[CH]2[CH](CO)O[C](O)(CO)[CH]2O)[CH](O)[CH](O)[CH]1O
CACTVS 3.370OC[C@H]1O[C@@H](O[C@@H]2[C@@H](CO)O[C@](O)(CO)[C@H]2O)[C@H](O)[C@@H](O)[C@H]1O
OpenEye OEToolkits 1.7.6C(C1C(C(C(C(O1)OC2C(OC(C2O)(CO)O)CO)O)O)O)O
OpenEye OEToolkits 1.7.6C([C@@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)O[C@@H]2[C@H](O[C@@]([C@H]2O)(CO)O)CO)O)O)O)O
ACDLabs 12.01OC2C(OC1OC(CO)C(O)C(O)C1O)C(OC2(O)CO)CO
Name:4-O-beta-D-galactopyranosyl-beta-D-fructofuranose
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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