CHEBI:53064 - 4-diphospho-1D-myo-inositol pentakisphosphate

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 4-diphospho-1D-myo-inositol pentakisphosphate
ChEBI ID CHEBI:53064
ChEBI ASCII Name 4-diphospho-1D-myo-inositol pentakisphosphate
Definition A 1D-myo-inositol pentakisphosphate compound with a diphosphate groups attached at the 4-position.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter kieran
Supplier Information
Download Molfile XML SDF
Formula C6H19O27P7
Net Charge 0
Average Mass 740.01520
Monoisotopic Mass 739.82770
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)/t1-,2-,3-,4+,5-,6-/m0/s1
InChIKey UPHPWXPNZIOZJL-CNWJWELYSA-N
SMILES OP(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
Metabolite of Species Details
Saccharomyces cerevisiae (NCBI:txid4932) Source: yeast.sf.net See: PubMed
Roles Classification
Biological Role(s): Saccharomyces cerevisiae metabolite
Any fungal metabolite produced during a metabolic reaction in Baker's yeast (Saccharomyces cerevisiae ).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 4-diphospho-1D-myo-inositol pentakisphosphate (CHEBI:53064) has functional parent myo-inositol (CHEBI:17268)
4-diphospho-1D-myo-inositol pentakisphosphate (CHEBI:53064) has role Saccharomyces cerevisiae metabolite (CHEBI:75772)
4-diphospho-1D-myo-inositol pentakisphosphate (CHEBI:53064) is a myo-inositol pentakisphosphate (CHEBI:25447)
IUPAC Name
1,2,3,5,6-pentakis-O-phosphono-1D-myo-inositol 4-(trihydrogen diphosphate)
Last Modified
21 January 2016