Record Information
Version1.0
StatusDetected and Quantified
Creation Date2021-11-18 00:06:14 UTC
Update Date2022-08-31 17:50:24 UTC
Metabolite IDMMDBc0030385
Metabolite Identification
Common NameD-Myo-inositol 1,2,4,5,6-pentakisphosphate
Descriptionmyo-Inositol 1,2,4,5,6-pentakisphosphate (Ins(1,2,4,5,6)P(5)) is an inositol polyphosphate. Ins(1,2,4,5,6)P5 and their close metabolic relatives are amongst the more abundant intracellular inositol polyphosphates and are important intermediates in inositol metabolism.
Structure
Synonyms
ValueSource
D-Myo-inositol 1,2,4,5,6-pentakisphosphoric acidGenerator
(D)-Isomer, specified as 1,2,4,5,6 OF inositol pentaphosphateMeSH
Inositol pentis(dihydrogen phosphate)MeSH
myo-Inositol pentakis(dihydrogen phosphate)MeSH
InsP5MeSH
Inositol pentakisphosphateMeSH
Inositol pentaphosphateMeSH
myo-Inositol 1,3,4,5,6-pentakisphosphateMeSH
{[(1R,3S,4R,6S)-2-hydroxy-3,4,5,6-tetrakis(phosphonooxy)cyclohexyl]oxy}phosphonateGenerator
Molecular FormulaC6H17O21P5
Average Mass580.0554
Monoisotopic Mass579.895040166
IUPAC Name{[(1S,3R,4S,6R)-2-hydroxy-3,4,5,6-tetrakis(phosphonooxy)cyclohexyl]oxy}phosphonic acid
Traditional Name[(1S,3R,4S,6R)-2-hydroxy-3,4,5,6-tetrakis(phosphonooxy)cyclohexyl]oxyphosphonic acid
CAS Registry Number20298-95-7
SMILES
[H]C1(O)[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@]1([H])OP(O)(O)=O
InChI Identifier
InChI=1S/C6H17O21P5/c7-1-2(23-28(8,9)10)4(25-30(14,15)16)6(27-32(20,21)22)5(26-31(17,18)19)3(1)24-29(11,12)13/h1-7H,(H2,8,9,10)(H2,11,12,13)(H2,14,15,16)(H2,17,18,19)(H2,20,21,22)/t1?,2-,3+,4+,5-,6?
InChI KeyCTPQAXVNYGZUAJ-UYSNGIAKSA-N