CHEBI:74946 - 1-diphospho-1D-myo-inositol 2,3,4,5,6-pentakisphosphate(13−)

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 1-diphospho-1D-myo-inositol 2,3,4,5,6-pentakisphosphate(13−)
ChEBI ID CHEBI:74946
ChEBI ASCII Name 1-diphospho-1D-myo-inositol 2,3,4,5,6-pentakisphosphate(13-)
Definition An inositol phosphate oxoanion obtained by global deprotonation of the phosphate and diphosphate OH groups of 1-diphospho-1D-myo-inositol 2,3,4,5,6-pentakisphosphate.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter KAX
Supplier Information
Download Molfile XML SDF
Formula C6H6O27P7
Net Charge -13
Average Mass 726.91200
Monoisotopic Mass 726.73311
InChI InChI=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
InChIKey UPHPWXPNZIOZJL-UOTPTPDRSA-A
SMILES [O-]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
ChEBI Ontology
Outgoing 1-diphospho-1D-myo-inositol 2,3,4,5,6-pentakisphosphate(13−) (CHEBI:74946) is a inositol phosphate oxoanion (CHEBI:76301)
1-diphospho-1D-myo-inositol 2,3,4,5,6-pentakisphosphate(13−) (CHEBI:74946) is conjugate base of 1-diphospho-1D-myo-inositol 2,3,4,5,6-pentakisphosphate (CHEBI:62919)
Incoming 1-diphospho-1D-myo-inositol 2,3,4,5,6-pentakisphosphate (CHEBI:62919) is conjugate acid of 1-diphospho-1D-myo-inositol 2,3,4,5,6-pentakisphosphate(13−) (CHEBI:74946)
Synonym Source
1-diphospho-myo-inositol 2,3,4,5,6-pentakisphosphate UniProt
Manual Xref Database
CPD-11700 MetaCyc
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Last Modified
02 December 2014