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BioLiP

PDB CCD ID: LYY
Number of entries in BioLiP: 1
Chemical formula: C5 H10 O4
InChI: InChI=1S/C5H10O4/c6-3-1-9-2-4(7)5(3)8/h3-8H,1-2H2/t3-,4-/m1/s1
InChIKey: QXAMTEJJAZOINB-QWWZWVQMSA-N
SMILES:
SoftwareSMILES
CACTVS 3.341O[C@@H]1COC[C@@H](O)[C@@H]1O
OpenEye OEToolkits 1.5.0C1[C@H](C([C@@H](CO1)O)O)O
CACTVS 3.341O[CH]1COC[CH](O)[CH]1O
ACDLabs 10.04OC1COCC(O)C1O
OpenEye OEToolkits 1.5.0C1C(C(C(CO1)O)O)O
Name:1,5-anhydro-D-arabinitol
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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