EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:195536 - 1D-myo-inositol 1,2,3-trisphosphate(6−)

ChEBI IDCHEBI:195536
ChEBI Name1D-myo-inositol 1,2,3-trisphosphate(6−)
Stars
ASCII Name1D-myo-inositol 1,2,3-trisphosphate(6-)
DefinitionThe hexaanion of 1D-myo-inositol 1,2,3-trisphosphate arising from global deprotonation of the phosphate OH groups. Major species at pH 7.3.
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC6H9O15P3
Net Charge-6
Average Mass414.045
Monoisotopic Mass413.91872
SMILESO=P([O-])([O-])O[C@@H]1[C@H](OP(=O)([O-])[O-])[C@@H](O)[C@H](O)[C@@H](O)[C@@H]1OP(=O)([O-])[O-]
InChIInChI=1S/C6H15O15P3/c7-1-2(8)4(19-22(10,11)12)6(21-24(16,17)18)5(3(1)9)20-23(13,14)15/h1-9H,(H2,10,11,12)(H2,13,14,15)(H2,16,17,18)/p-6/t1-,2-,3+,4+,5-,6+
InChIKeyGKDKOMAJZATYAY-QWBQGLJISA-H
ChEBI Ontology
Outgoing Relation(s)
1D-myo-inositol 1,2,3-trisphosphate(6−) (CHEBI:195536) is a inositol phosphate oxoanion (CHEBI:76301)
UniProt Name  Source
1D-myo-inositol 1,2,3-trisphosphateUniProt
Manual XrefsDatabases
CPD-6745MetaCyc
Citations