Deoxythymidine triphosphate

HCID 1151

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Basic information

Standard SMILES: Cc1cn(C2CC(O)C(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O2)c(=O)[nH]c1=O
InChIKey: NHVNXKFIZYSCEB-UHFFFAOYSA-N
Molecular formula: C10H17N2O14P3
Average molar mass: 482.17 g/mol
Monoisotopic mass: 481.98926421

Overview

thymidine triphosphate has been reported in Homo sapiens with data available.

Names & identifiers

Preferred name: Deoxythymidine triphosphate
IUPAC: [hydroxy-[[3-hydroxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy]phosphoryl] phosphono hydrogen phosphate

Names & synonyms

Deoxythymidine triphosphate[hydroxy-[[3-hydroxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy]phosphoryl] phosphono hydrogen phosphate(hydroxy-((3-hydroxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl)methoxy)phosphoryl) phosphono hydrogen phosphateRefChem:10831561-[2-deoxy-5-o-(hydroxy{[hydroxy(phosphonooxy)phosphoryl]oxy}phosphoryl)pentofuranosyl]-5-methylpyrimidine-2,4(1h,3h)-dione27821-54-1SCHEMBL21275938DTXSID70861903{[hydroxy({[hydroxy({[(2R,3S,5R)-3-hydroxy-5-(4-hydroxy-5-methyl-2-oxo-1,2-dihydropyrimidin-1-yl)oxolan-2-yl]methoxy})phosphoryl]oxy})phosphoryl]oxy}phosphonic acidDB-085696[Hydroxy-[[(2R,5R)-3-hydroxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy]phosphoryl] phosphono hydrogen phosphate154117-14-3

Database identifiers

PubChem CID: 1151
DTXSID: DTXSID70861903

Properties

Computed structural properties

XLogP: -5
Topological polar surface area: 239 Å²
Hydrogen bond donors: 6
Hydrogen bond acceptors: 14
Rotatable bonds: 8
Heavy atoms: 29
Formal charge: 0
Complexity: 853

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