uridine triphosphate   Click here for help

GtoPdb Ligand ID: 1734

Abbreviated name: UTP
Synonyms: 5'-UTP | uridine 5'-triphosphate
PDB Ligand
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 15
Hydrogen bond donors 7
Rotatable bonds 8
Topological polar surface area 293.8
Molecular weight 483.97
XLogP -5.54
No. Lipinski's rules broken 2
SMILES / InChI / InChIKey
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Canonical SMILES OC1C(COP(=O)(OP(=O)(OP(=O)(O)O)O)O)OC(C1O)n1ccc(=O)[nH]c1=O
Isomeric SMILES O[C@@H]1[C@@H](COP(=O)(OP(=O)(OP(=O)(O)O)O)O)O[C@H]([C@@H]1O)n1ccc(=O)[nH]c1=O
InChI InChI=1S/C9H15N2O15P3/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(24-8)3-23-28(19,20)26-29(21,22)25-27(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H,21,22)(H,10,12,15)(H2,16,17,18)/t4-,6-,7-,8-/m1/s1
InChI Key PGAVKCOVUIYSFO-XVFCMESISA-N
Classification Click here for help
Compound class Metabolite or derivative
IUPAC Name Click here for help
[(2R,3S,4R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl (hydroxy-phosphonooxyphosphoryl) hydrogen phosphate
Synonyms Click here for help
5'-UTP | uridine 5'-triphosphate
Database Links Click here for help
BindingDB Ligand 50118213
CAS Registry No. 63-39-8 (source: Scifinder)
ChEBI CHEBI:15713
ChEMBL Ligand CHEMBL336296
DrugBank Ligand DB04005
DrugCentral Ligand 3639
GtoPdb PubChem SID 135651592
PubChem CID 6133
RCSB PDB Ligand UTP
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Wikipedia Uridine_triphosphate