2'-Deoxyuridine-5'-triphosphoric acid = dUTP

HCID 689

Notes Reactions

Substructure search Find similar structures

Basic information

Standard SMILES: O=c1ccn(C2CC(O)C(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O2)c(=O)[nH]1
InChIKey: AHCYMLUZIRLXAA-UHFFFAOYSA-N
Molecular formula: C9H15N2O14P3
Average molar mass: 468.14 g/mol
Monoisotopic mass: 467.97361415

Names & identifiers

Preferred name: 2'-Deoxyuridine-5'-triphosphoric acid = dUTP
IUPAC: [[5-(2,4-dioxopyrimidin-1-yl)-3-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate

Names & synonyms

2'-Deoxyuridine-5'-triphosphoric acid = dUTPSCHEMBL12729520DTXSID508625741-[2-Deoxy-5-O-(hydroxy{[hydroxy(phosphonooxy)phosphoryl]oxy}phosphoryl)pentofuranosyl]pyrimidine-2,4(1H,3H)-dione

Database identifiers

PubChem CID: 689
DTXSID: DTXSID50862574

Properties

Computed structural properties

XLogP: -5.5
Topological polar surface area: 239 Å²
Hydrogen bond donors: 6
Hydrogen bond acceptors: 14
Rotatable bonds: 8
Heavy atoms: 28
Formal charge: 0
Complexity: 808

Related reactions

2 records

New reaction record

HRID 315067As reactantTraining data from https://doi.org/10.1039/C8SC04228D (8/10)

HRID 2332328As productAs reactantTraining data from https://doi.org/10.1039/C8SC04228D (10/10)

Compound notes

Loading…