SEQ2FUN

BioLiP

PDB CCD ID: F1X
Number of entries in BioLiP: 3
Chemical formula: C6 H13 O9 P
InChI: InChI=1S/C6H13O9P/c7-1-3-4(8)5(9)6(10,15-3)2-14-16(11,12)13/h3-5,7-10H,1-2H2,(H2,11,12,13)/t3-,4-,5+,6-/m1/s1
InChIKey: RHKKZBWRNHGJEZ-ARQDHWQXSA-N
SMILES:
SoftwareSMILES
CACTVS 3.370OC[CH]1O[C](O)(CO[P](O)(O)=O)[CH](O)[CH]1O
ACDLabs 12.01O=P(OCC1(O)OC(C(O)C1O)CO)(O)O
OpenEye OEToolkits 1.7.0C(C1C(C(C(O1)(COP(=O)(O)O)O)O)O)O
OpenEye OEToolkits 1.7.0C([C@@H]1[C@H]([C@@H]([C@](O1)(COP(=O)(O)O)O)O)O)O
CACTVS 3.370OC[C@H]1O[C@](O)(CO[P](O)(O)=O)[C@@H](O)[C@@H]1O
Name:1-O-phosphono-beta-D-fructofuranose;
beta D-Fructose 1-phosphate;
1-O-phosphono-beta-D-fructose;
1-O-phosphono-D-fructose;
1-O-phosphono-fructose
ChEMBL: CHEMBL605021
ZINC: ZINC000004095539
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).