SEQ2FUN

BioLiP

PDB CCD ID: AXR
Number of entries in BioLiP: 6
Chemical formula: C6 H12 O5
InChI: InChI=1S/C6H12O5/c1-10-6-5(9)4(8)3(2-7)11-6/h3-9H,2H2,1H3/t3-,4-,5+,6+/m1/s1
InChIKey: NALRCAPFICWVAQ-ZXXMMSQZSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 1.5.0COC1C(C(C(O1)CO)O)O
CACTVS 3.341CO[C@H]1O[C@H](CO)[C@@H](O)[C@@H]1O
OpenEye OEToolkits 1.5.0CO[C@@H]1[C@H]([C@@H]([C@H](O1)CO)O)O
CACTVS 3.341CO[CH]1O[CH](CO)[CH](O)[CH]1O
ACDLabs 10.04OC1C(OC(OC)C1O)CO
Name:methyl alpha-D-arabinofuranoside;
1-O-methyl-alpha-D-arabinofuranoside;
methyl alpha-D-arabinoside;
methyl D-arabinoside;
methyl arabinoside
ZINC: ZINC000017143134
Reference:
  • Chengxin Zhang, Xi Zhang, Lydia 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).