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BioLiP

PDB CCD ID: 7CV
Number of entries in BioLiP: 1
Chemical formula: C8 H16 O5
InChI: InChI=1S/C8H16O5/c1-4-5(9)6(11-2)7(12-3)8(10)13-4/h4-10H,1-3H3/t4-,5-,6+,7+,8+/m0/s1
InChIKey: SXWBIRCAXZNEGK-TVNFTVLESA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 2.0.6C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O)OC)OC)O
ACDLabs 12.01C1(O)C(OC)C(C(C(O1)C)O)OC
OpenEye OEToolkits 2.0.6CC1C(C(C(C(O1)O)OC)OC)O
CACTVS 3.385CO[CH]1[CH](O)O[CH](C)[CH](O)[CH]1OC
CACTVS 3.385CO[C@H]1[C@H](O)O[C@@H](C)[C@H](O)[C@H]1OC
Name:6-deoxy-2,3-di-O-methyl-alpha-L-mannopyranose;
6-deoxy-2,3-di-O-methyl-alpha-L-mannose;
6-deoxy-2,3-di-O-methyl-L-mannose;
6-deoxy-2,3-di-O-methyl-mannose
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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