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BioLiP Library

PDB CCD ID: TVG
Number of entries in BioLiP: 1
Chemical formula: C9 H18 O6
InChI: InChI=1S/C9H18O6/c1-2-3-14-9-7(13)6(12)8(15-9)5(11)4-10/h5-13H,2-4H2,1H3/t5-,6-,7-,8+,9-/m1/s1
InChIKey: HCLWENMJMONBDC-GOFVFXDOSA-N
SMILES:
SoftwareSMILES
CACTVS 3.385CCCO[C@@H]1O[C@@H]([C@H](O)CO)[C@H](O)[C@H]1O
ACDLabs 12.01OC1C(OC(C1O)OCCC)C(CO)O
CACTVS 3.385CCCO[CH]1O[CH]([CH](O)CO)[CH](O)[CH]1O
OpenEye OEToolkits 2.0.7CCCO[C@H]1[C@@H]([C@H]([C@@H](O1)[C@@H](CO)O)O)O
OpenEye OEToolkits 2.0.7CCCOC1C(C(C(O1)C(CO)O)O)O
Name:propyl beta-D-galactofuranoside
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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