Terminology Service for NFDI4Health

myo-inositol hexakisphosphate(12-)

Go to external page http://purl.obolibrary.org/obo/CHEBI_58130


The organophosphate oxoanion formed by loss of 2 protons from each of the phosphate groups of 1D-myo-inositol.

Term info

Label

myo-inositol hexakisphosphate(12-)

Synonyms
  • (1R,2S,3r,4R,5S,6s)-cyclohexane-1,2,3,4,5,6-hexayl hexakis(phosphate)
  • 1D-myo-inositol hexakisphosphate
  • myo-inositol hexakisphosphate
database cross reference
Subsets

3_STAR

IUPAC NAME
1D-myo-inositol hexakisphosphate [ IUPAC ]

IUPAC NAME
myo-inositol hexakisphosphate [ IUPAC ]

IUPAC NAME
(1R,2S,3r,4R,5S,6s)-cyclohexane-1,2,3,4,5,6-hexayl hexakis(phosphate) [ IUPAC ]

charge

-12

formula

C6H6O24P6

has obo namespace

chebi_ontology

has related synonym

1D-myo-inositol hexakisphosphate, [2,3,4,5,6-pentakis(phosphonatooxy)cyclohexyl] phosphate

id

CHEBI:58130

inchi

InChI=1S/C6H18O24P6/c7-31(8,9)25-1-2(26-32(10,11)12)4(28-34(16,17)18)6(30-36(22,23)24)5(29-35(19,20)21)3(1)27-33(13,14)15/h1-6H,(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-12/t1-,2-,3-,4+,5-,6-

inchikey

IMQLKJBTEOYOSI-GPIVLXJGSA-B

mass

647.94000

monoisotopicmass

647.77406

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-])=O)[C@H](OP([O-])([O-])=O)[C@H]1OP([O-])([O-])=O