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CHEBI:16039 - ITP

ChEBI IDCHEBI:16039
ChEBI NameITP
Stars
DefinitionThe inosine phosphate that has a triphosphate group at the 5'-position. It is an intermediate in the metabolism of purine.
Secondary ChEBI IDsCHEBI:5851, CHEBI:13374, CHEBI:19272, CHEBI:43508
Last Modified27 January 2016
DownloadsMolfile
FormulaC10H15N4O14P3
Net Charge0
Average Mass508.166
Monoisotopic Mass507.97976
SMILESO=c1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O
InChIInChI=1S/C10H15N4O14P3/c15-6-4(1-25-30(21,22)28-31(23,24)27-29(18,19)20)26-10(7(6)16)14-3-13-5-8(14)11-2-12-9(5)17/h2-4,6-7,10,15-16H,1H2,(H,21,22)(H,23,24)(H,11,12,17)(H2,18,19,20)/t4-,6-,7-,10-/m1/s1
InChIKeyHAEJPQIATWHALX-KQYNXXCUSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090)
- PubMed (20601097)
- PubMed (19425150) Source: BioModels - MODEL1507180067
Homo sapiens (ncbitaxon:9606) - PubMed (24227841)
Escherichia coli (ncbitaxon:562) - PubMed (21988831)
Roles Classification
Biological Roles:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
Escherichia coli metabolite  Any bacterial metabolite produced during a metabolic reaction in Escherichia coli.
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
ChEBI Ontology
Outgoing Relation(s)
ITP (CHEBI:16039) has role Escherichia coli metabolite (CHEBI:76971)
ITP (CHEBI:16039) has role human metabolite (CHEBI:77746)
ITP (CHEBI:16039) has role mouse metabolite (CHEBI:75771)
ITP (CHEBI:16039) is a inosine phosphate (CHEBI:24843)
ITP (CHEBI:16039) is a purine ribonucleoside 5'-triphosphate (CHEBI:37045)
ITP (CHEBI:16039) is conjugate acid of ITP(3−) (CHEBI:57614)
ITP (CHEBI:16039) is conjugate acid of ITP(4−) (CHEBI:61402)
Incoming Relation(s)
ethyl-ITP (CHEBI:62907) has functional parent ITP (CHEBI:16039)
ITP(3−) (CHEBI:57614) is conjugate base of ITP (CHEBI:16039)
ITP(4−) (CHEBI:61402) is conjugate base of ITP (CHEBI:16039)
IUPAC Name 
inosine 5'-(tetrahydrogen triphosphate)
Synonyms  Source
ITPKEGG COMPOUND
Inosine 5'-triphosphateKEGG COMPOUND
Inosine triphosphateKEGG COMPOUND
Inosine tripolyphosphateKEGG COMPOUND
2'-inosine-5'-triphosphateChEBI
O5'-(tetrahydroxytriphosphoryl)inosineChEBI
Manual XrefsDatabases
C00081KEGG COMPOUND
C00081KEGG COMPOUND
ITTPDBeChem
HMDB0000189HMDB
ITPMetaCyc
YMDB00559YMDB
ECMDB00189ECMDB
Registry NumbersSources
Reaxys:600524Reaxys
CAS:132-06-9KEGG COMPOUND
Citations