SEQ2FUN

BioLiP

PDB CCD ID: DOM
Number of entries in BioLiP: 0
Chemical formula: C12 H22 O10
InChI: InChI=1S/C12H22O10/c13-2-5-8(17)9(18)10(19)12(21-5)22-11-4(15)1-7(16)20-6(11)3-14/h4-19H,1-3H2/t4-,5-,6-,7+,8-,9+,10-,11+,12-/m1/s1
InChIKey: FDCIWBIYHZDLEG-AEEGTDTOSA-N
SMILES:
SoftwareSMILES
CACTVS 3.341OC[CH]1O[CH](O[CH]2[CH](O)C[CH](O)O[CH]2CO)[CH](O)[CH](O)[CH]1O
ACDLabs 10.04O(C1C(OC(O)CC1O)CO)C2OC(C(O)C(O)C2O)CO
OpenEye OEToolkits 1.5.0C1[C@H]([C@@H]([C@H](O[C@@H]1O)CO)O[C@@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)O
OpenEye OEToolkits 1.5.0C1C(C(C(OC1O)CO)OC2C(C(C(C(O2)CO)O)O)O)O
CACTVS 3.341OC[C@H]1O[C@H](O[C@H]2[C@H](O)C[C@@H](O)O[C@@H]2CO)[C@H](O)[C@@H](O)[C@@H]1O
Name:2'-DEOXYMALTOSE
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).