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5-n-Hexyl-2'-deoxyuridine triphosphate

HCID 188355
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Basic information

CAS
64374-81-8
Standard SMILES
CCCCCCc1cn([C@H]2C[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O2)c(=O)[nH]c1=O
InChIKey
QMJGOUUUYOWMJP-YNEHKIRRSA-N
Molecular formula
C15H27N2O14P3
Average molar mass
552.3 g/mol
Monoisotopic mass
552.06751453

Names & identifiers

Preferred name
5-n-Hexyl-2'-deoxyuridine triphosphate
IUPAC
[[(2R,3S,5R)-5-(5-hexyl-2,4-dioxopyrimidin-1-yl)-3-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate
English name
5-n-hexyl-2'-deoxyuridine triphosphate
Molecular formula
C15H27N2O14P3
Molecular weight
552.3

Names & synonyms

5-Hxdutp64374-81-85-n-Hexyl-2'-deoxyuridine triphosphateDTXSID80214587Uridine 5'-(tetrahydrogen triphosphate), 2'-deoxy-5-hexyl-RefChem:103244DTXCID101370782'-deoxy-5-hexyluridine 5'-(tetrahydrogen triphosphate)Uridine 5'-(tetrahydrogen triphosphate), 2'-deoxy-5-hexyl- (9CI)

Database identifiers

CAS
64374-81-8
PubChem CID
188355
DTXSID
DTXSID80214587

Properties

Computed structural properties

XLogP
-2.4
Topological polar surface area
239 Ų
Hydrogen bond donors
6
Hydrogen bond acceptors
14
Rotatable bonds
13
Heavy atoms
34
Formal charge
0
Complexity
935

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Compound notes

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