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

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name 6-diphospho-1D-myo-inositol pentakisphosphate(13−)
ChEBI ID CHEBI:230534
ChEBI ASCII Name 6-diphospho-1D-myo-inositol pentakisphosphate(13-)
Definition Major species at pH 7.3.
Stars This entity has been manually annotated by a third party.
Submitter Kristian Axelsen
Supplier Information No supplier information found for this compound.
Download Molfile XML SDF
Formula C6H6O27P7
Net Charge -13
Average Mass 726.910
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-XCMZKKERSA-A
SMILES [C@H]1(OP([O-])(=O)[O-])[C@@H](OP([O-])(=O)[O-])[C@@H](OP([O-])(=O)[O-])[C@@H]([C@H]([C@@H]1OP(=O)([O-])[O-])OP(=O)([O-])[O-])OP(=O)(OP([O-])(=O)[O-])[O-]
ChEBI Ontology
Outgoing 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 6-diphospho-1D-myo-inositol pentakisphosphate (CHEBI:53065) is conjugate acid of 6-diphospho-1D-myo-inositol pentakisphosphate(13−) (CHEBI:230534)
Synonym Source
6-diphospho-1D-myo-inositol pentakisphosphate UniProt
Manual Xref Database
CPD-11702 MetaCyc accession
View more database links