sucrose

Ligand id: 5411

Name: sucrose

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 11
Hydrogen bond donors 8
Rotatable bonds 5
Topological polar surface area 189.53
Molecular weight 342.12
XLogP -3.28
No. Lipinski's rules broken 2

Molecular properties generated using the CDK

Classification
Compound class Metabolite or derivative
IUPAC Name
(2R,3R,4S,5S,6R)-2-{[(2S,3S,4S,5R)-3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol
Synonyms
saccharose
Database Links
CAS Registry No. 57-50-1
ChEBI CHEBI:17992
ChEMBL Ligand CHEMBL253582
DrugBank Ligand DB02772
PubChem CID 5988
RCSB PDB Ligand SUC
Search Google for chemical match using the InChIKey CZMRCDWAGMRECN-UGDNZRGBSA-N
Search Google for chemicals with the same backbone CZMRCDWAGMRECN
Search UniChem for chemical match using the InChIKey CZMRCDWAGMRECN-UGDNZRGBSA-N
Search UniChem for chemicals with the same backbone CZMRCDWAGMRECN
Wikipedia Sucrose