dATP(4-) (CHEBI:61404)

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CHEBI:61404 - dATP(4−)

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ChEBI ID	CHEBI:61404
ChEBI Name	dATP(4−)
Stars
ASCII Name	dATP(4-)
Definition	A 2'-deoxyribonucleoside 5'-triphosphate(4−) that is the tetraanion of 2'-deoxyadenosine 5'-triphosphate (dATP), arising from deprotonation of the four triphosphate OH groups; major species at pH 7.3.
Last Modified	27 July 2021
Submitter	Anne Morgat
Downloads	Molfile

Formula	C10H12N5O12P3
Net Charge	-4
Average Mass	487.151
Monoisotopic Mass	486.97173
SMILES	Nc1ncnc2c1ncn2[C@H]1C[C@H](O)[C@@H](COP(=O)([O-])OP(=O)([O-])OP(=O)([O-])[O-])O1
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)/p-4/t5-,6+,7+/m0/s1
InChIKey	SUYVUBYJARFZHO-RRKCRQDMSA-J

Species of Metabolite	Component	Source	Comments
Homo sapiens (ncbitaxon:9606)	-	DOI (10.1038/nbt.2488)
Saccharomyces cerevisiae (ncbitaxon:4932)	-	PubMed (24678285)	Source: yeast.sf.net

Roles Classification

Biological Roles:

Saccharomyces cerevisiae metabolite Any fungal metabolite produced during a metabolic reaction in Baker's yeast (Saccharomyces cerevisiae ).

human metabolite Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).

ChEBI Ontology

Outgoing Relation(s)
	dATP(4−) (CHEBI:61404) has role Saccharomyces cerevisiae metabolite (CHEBI:75772)
	dATP(4−) (CHEBI:61404) has role human metabolite (CHEBI:77746)
	dATP(4−) (CHEBI:61404) is a 2'-deoxyribonucleoside 5'-triphosphate(4−) (CHEBI:61560)
	dATP(4−) (CHEBI:61404) is conjugate base of dATP(3−) (CHEBI:495505)
Incoming Relation(s)
Incoming Relation(s)	dATP(3−) (CHEBI:495505) is conjugate acid of dATP(4−) (CHEBI:61404)

IUPAC Name
2'-deoxy-5'-O-({[(phosphonatooxy)phosphinato]oxy}phosphinato)adenosine

Synonyms	Source
dATP tetraanion	SUBMITTER
2'-deoxyadenosine 5'-triphosphate(4-)	SUBMITTER
2'-deoxyadenosine 5'-triphosphate tetraanion	ChEBI
2'-deoxyadenosine 5'-triphosphate	ChEBI

UniProt Name	Source
dATP	UniProt

Manual Xrefs	Databases
DATP	MetaCyc

Registry Numbers	Sources
Reaxys:5788808	Reaxys