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5-diphospho-1D-myo-inositol 1,2,3,4,6-pentakisphosphate

Properties

Image

Occurences in reactions

MNX_ID

MNXM1102135

	#reac
in my sandbox	0
in MNXref (generic)	9
in models (compartimentalized)	9

formula

C₆H₆O₂₇P₇

charge

-13

mass

726.73311

reference

chebi:58628

InChIKey

UPHPWXPNZIOZJL-KXXVROSKSA-A

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+

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

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:58628 chebi:58628	5-diphospho-1D-myo-inositol 1,2,3,4,6-pentakisphosphate 1,2,3,4,6-pentakis-O-phosphonato-1D-myo-inositol 5-diphosphate 5-diphospho-1D-myo-inositol pentakisphosphate(13-)
metacyc.compound:5-DIPHOSPHO-1D-MYO-INOSITOL-12346P metacycM:5-DIPHOSPHO-1D-MYO-INOSITOL-12346P	1D-myoinositol 5-diphosphate 1,2,3,4,6-pentakisphosphate (1r,2R,3S,4s,5R,6S)-2,3,4,5,6-pentakis(phosphonooxy)cyclohexyl trihydrogen diphosphate 5-PP-InsP5 5-diphospho-1D-myo-inositol 1,2,3,4,6-pentakisphosphate 5-diphospho-1D-myo-inositol pentakisphosphate diphosphoinositol pentakisphosphate
bigg.metabolite:ppmi12346p biggM:ppmi12346p	5 Diphosphoinositol pentakisphosphate
hmdb:HMDB0006229	5-Diphosphoinositol pentakisphosphate (1R,2R,3S,4S,5R,6S)-2,3,4,5,6-Pentakis(phosphonooxy)cyclohexyl trihydrogen diphosphate (1R,2R,3S,4S,5R,6S)-2,3,4,5,6-Pentakis(phosphonooxy)cyclohexyl trihydrogen diphosphoric acid 1,2,3,4,6-Pentakis-O-phosphono-1D-myo-inositol 5-(trihydrogen diphosphate) 1-O-Diphospho-D-myo-inositol pentakisphosphate 1D-Myo-inositol 5-diphosphate 1,2,3,4,6-pentakisphosphate 1D-Myo-inositol 5-diphosphate pentakisphosphate 1D-Myo-inositol 5-diphosphoric acid 1,2,3,4,6-pentakisphosphoric acid 1D-Myo-inositol 5-diphosphoric acid pentakisphosphoric acid 5-Diphospho-1D-myo-inositol 1,2,3,4,6-pentakisphosphate 5-Diphospho-1D-myo-inositol pentakisphosphate 5-Diphosphoinositol pentakisphosphoric acid 5-PP-InsP5 5beta 5pp-IP5 5beta-IP7 Diphosphoinositol pentakisphosphate IP7 InsP7 PP-InsP5 [(1R,2r,3S,4R,5s,6S)-2-{[hydroxy(phosphonooxy)phosphoryl]oxy}-3,4,5,6-tetrakis(phosphonooxy)cyclohexyl]oxyphosphonic acid myo-Inositol 1,2,3,4,6-pentakis(dihydrogen phosphate) 5-(trihydrogen diphosphate) {[(1R,2r,3S,4R,5s,6S)-2-{[hydroxy(phosphonooxy)phosphoryl]oxy}-3,4,5,6-tetrakis(phosphonooxy)cyclohexyl]oxy}phosphonic acid
seed.compound:cpd08361 seedM:cpd08361	5-PP-InsP5 (1r,2R,3S,4s,5R,6S)-2,3,4,5,6-pentakis(phosphonooxy)cyclohexyl trihydrogen diphosphate 1D-myo-Inositol 5-diphosphate 1,2,3,4,6-pentakisphosphate 1D-myo-Inositol 5-diphosphate pentakisphosphate 1D-myoinositol 5-diphosphate 1,2,3,4,6-pentakisphosphate 5-Diphosphoinositol pentakisphosphate 5-diphospho-1D-myo-inositol (1,2,3,4,6)pentakisphosphate 5-diphospho-1D-myo-inositol 1,2,3,4,6-pentakisphosphate 5-diphospho-1D-myo-inositol pentakisphosphate diphosphoinositol pentakisphosphate ppmi12346p
kegg.compound:C11526 keggC:C11526	5-PP-InsP5 1D-myo-Inositol 5-diphosphate 1,2,3,4,6-pentakisphosphate 1D-myo-Inositol 5-diphosphate pentakisphosphate 5-Diphosphoinositol pentakisphosphate
sabiork.compound:13589 sabiorkM:13589	5-PP-InsP5 1D-myo-inositol 5-diphosphate 1,2,3,4,6-pentakisphosphate 5-Diphosphoinositol pentakisphosphate IP7 PP-InsP5
reactome:R-ALL-1629765 reactomeM:R-ALL-1629765 reactome:R-ALL-2023940 reactomeM:R-ALL-2023940 CHEBI:30164 chebi:30164	5-diphospho-1D-myo-inositol pentakisphosphate (1r,2R,3S,4s,5R,6S)-2,3,4,5,6-pentakis(phosphonooxy)cyclohexyl trihydrogen diphosphate 1,2,3,4,6-pentakis-O-phosphono-1D-myo-inositol 5-(trihydrogen diphosphate) 1D-myo-Inositol 5-diphosphate pentakisphosphate 1D-myo-inositol 5-diphosphate 1,2,3,4,6-pentakisphosphate 1D-myo-inositol 5-diphosphate pentakisphosphate 5-Diphosphoinositol pentakisphosphate 5-PP-InsP5
seed.compound:cpd36883 seedM:cpd36883	CPD-11933
metacyc.compound:CPD-11933 metacycM:CPD-11933	a diphospho-1D-myo-inositol pentakisphosphate PP-InsP5 a diphosphoinositol pentakisphosphate
hmdb:HMDB06229 chebi:12124 chebi:2119 biggM:M_ppmi12346p keggC:M_C11526 seedM:M_cpd08361 seedM:M_cpd36883	secondary/obsolete/fantasy identifier