Deoxyadenosine 5'-triphosphate (dATP)

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Systematic / IUPAC Name: 9-[2-Deoxy-5-O-(hydroxy{[hydroxy(phosphonooxy)phosphoryl]oxy}phosphoryl)pentofuranosyl]-9H-purin-6-amine

ID: Reference374

Other Names: Deoxyadenosine triphosphate;
2'-Deoxyadenosine 5'-triphosphate;
2'-Deoxy-ATP;
2'-Deoxyformycin-5'-triphosphate;
5'-dATP

Formula: C10H16N5O12P3

Class: Endogenous Metabolites

Spectral Data

Deoxyadenosine 5'-triphosphate (dATP) mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

View Mass Spectra

Available MS Data

Used Instruments Orbitrap Elite
No. of Spectral Trees 2
No. of Spectra 341
Tandem Spectra MS1, MS2, MS3, MS4, MS5
Ionization Methods ESI
Analyzers FT
Last Modification 1/9/2015 11:08:16 AM
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Identificators

InChI InChI=1S/C10H16N5O12P3/c11-9-8-10(13-3-12-9)15(4-14-8)7-1-5(16)6(25-7)2-24-29(20,21)27-30(22,23)26-28(17,18)19/h3-7,16H,1-2H2,(H,20,21)(H,22,23)(H2,11,12,13)(H2,17,18,19)/t5-,6+,7+/m0/s1
InChI Key SUYVUBYJARFZHO-RRKCRQDMSA-N
Canonical SMILES O=P(O)(O)OP(=O)(O)OP(=O)(O)OCC3OC(n2cnc1c(ncnc12)N)CC3O
CAS 1927317
Splash
Other Names Deoxyadenosine triphosphate;
2'-Deoxyadenosine 5'-triphosphate;
2'-Deoxy-ATP;
2'-Deoxyformycin-5'-triphosphate;
5'-dATP;
Adenosine, 5'-(tetrahydrogen triphosphate), 2'-deoxy-

In Other Databases

Wikipedia Deoxyadenosine triphosphate
ChEBI CHEBI:16284
KEGG C00131
PubChem 15993
ChEMBL CHEMBL335538
HMDb HMDB01532
ChemIDPlus 001927317; 067460177
ChemSpider 15194