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CHEBI:230534 - 6-diphospho-1D-myo-inositol pentakisphosphate(13−)

ChEBI IDCHEBI:230534
ChEBI Name6-diphospho-1D-myo-inositol pentakisphosphate(13−)
Stars
ASCII Name6-diphospho-1D-myo-inositol pentakisphosphate(13-)
DefinitionMajor species at pH 7.3.
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC6H6O27P7
Net Charge-13
Average Mass726.905
Monoisotopic Mass726.73311
SMILESO=P([O-])([O-])O[C@H]1[C@@H](OP(=O)([O-])[O-])[C@@H](OP(=O)([O-])[O-])[C@H](OP(=O)([O-])OP(=O)([O-])[O-])[C@@H](OP(=O)([O-])[O-])[C@@H]1OP(=O)([O-])[O-]
InChIInChI=1S/C6H19O27P7/c7-34(8,9)27-1-2(28-35(10,11)12)4(30-37(16,17)18)6(32-40(25,26)33-39(22,23)24)5(31-38(19,20)21)3(1)29-36(13,14)15/h1-6H,(H,25,26)(H2,7,8,9)(H2,10,11,12)(H2,13,14,15)(H2,16,17,18)(H2,19,20,21)(H2,22,23,24)/p-13/t1-,2-,3-,4+,5-,6-/m1/s1
InChIKeyUPHPWXPNZIOZJL-XCMZKKERSA-A
ChEBI Ontology
Outgoing Relation(s)
6-diphospho-1D-myo-inositol pentakisphosphate(13−) (CHEBI:230534) is a inositol phosphate oxoanion (CHEBI:76301)
6-diphospho-1D-myo-inositol pentakisphosphate(13−) (CHEBI:230534) is conjugate base of 6-diphospho-1D-myo-inositol pentakisphosphate (CHEBI:53065)
Incoming Relation(s)
6-diphospho-1D-myo-inositol pentakisphosphate (CHEBI:53065) is conjugate acid of 6-diphospho-1D-myo-inositol pentakisphosphate(13−) (CHEBI:230534)
UniProt Name  Source
6-diphospho-1D-myo-inositol pentakisphosphateUniProt
Manual XrefsDatabases
CPD-11702MetaCyc