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

PropertiesImage
MNX_IDMNXM1371917 Image of MNXM1371917
referencechebi:74946
formulaC6H6O27P7
global charge-13
mol weight726.905
InChIKeyUPHPWXPNZIOZJL-UOTPTPDRSA-A
InChIInChI=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
SMILESO=P([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-]
MNX internals
InChI (mnx)InChI=1/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-/m1/s1 Image of MNXM1371917
SMILES (mnx)[C@@H:1]1([O:27][P:34]([OH:7])([OH:8])=[O:9])[C@@H:2]([O:28][P:35]([OH:10])([OH:11])=[O:12])[C@@H:4]([O:30][P:37]([OH:16])([OH:17])=[O:18])[C@@H:6]([O:32][P:40]([OH:25])(=[O:26])[O:33][P:39]([OH:22])([OH:23])=[O:24])[C@H:5]([O:31][P:38]([OH:19])([OH:20])=[O:21])[C@H:3]1[O:29][P:36]([OH:13])([OH:14])=[O:15]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)4
in models (compartimentalized) 4
Similar chemical compounds in external resources
IdentifierDescription

reactome:R-ALL-1629740
reactomeM:R-ALL-1629740
reactome:R-ALL-2023932
reactomeM:R-ALL-2023932
CHEBI:74946
chebi:74946
UPHPWXPNZIOZJL-UOTPTPDRSA-A 		1-diphospho-1D-myo-inositol 2,3,4,5,6-pentakisphosphate
1-diphospho-1D-myo-inositol 2,3,4,5,6-pentakisphosphate(13-)
hmdb:HMDB0012494
UPHPWXPNZIOZJL-UOTPTPDRSA-N 		1-Diphosinositol pentakisphosphate
(1R,2R,3R,4R,5S,6R)-2,3,4,5,6-Pentakis(phosphonooxy)cyclohexyl trihydrogen diphosphate
(1R,2R,3R,4R,5S,6R)-2,3,4,5,6-Pentakis(phosphonooxy)cyclohexyl trihydrogen diphosphoric acid
1-Diphosinositol pentakisphosphoric acid
1-Diphospho-1D-myo-inositol 2,3,4,5,6-pentakisphosphoric acid
1-Dpipk
1-O-Diphospho-D-myo-inositol pentakisphosphate
1-PP-IP5
1-dpipk
1D-Myo-inositol 1-diphosphate 2,3,4,5,6-pentakisphosphate
1D-Myo-inositol 1-diphosphoric acid 2,3,4,5,6-pentakisphosphoric acid
D-Myo-inositol, 2,3,4,5,6-pentakis(dihydrogen phosphate) 1-(trihydrogen diphosphate)
D-Myo-inositol, 2,3,4,5,6-pentakis(dihydrogen phosphoric acid) 1-(trihydrogen diphosphoric acid)
Diphospho-myo-inositol pentakisphosphate
Diphospho-myo-inositol pentakisphosphoric acid
Diphosphoinositol pentakisphosphate
Diphosphoinositol pentakisphosphoric acid
IP7
InsP7
PP-IP(5)
{[(1S,2R,3S,4R,5R,6S)-3-{[hydroxy(phosphonooxy)phosphoryl]oxy}-2,4,5,6-tetrakis(phosphonooxy)cyclohexyl]oxy}phosphonic acid

seed.compound:cpd08050
seedM:cpd08050
UPHPWXPNZIOZJL-UOTPTPDRSA-B 		1-Diphosinositol pentakisphosphate
1-diphosinositol pentakisphosphate
1-diphospho-1D-myo-inositol (2,3,4,5,6)pentakisphosphate
1-diphospho-1D-myo-inositol 2,3,4,5,6-pentakisphosphate
1D-myo-Inositol 1-diphosphate 2,3,4,5,6-pentakisphosphate
1D-myo-inositol 1-diphosphate 2,3,4,5,6-pentakisphosphate
1D-myo-inositol 1-diphosphate pentakisphosphate
D-myo-Inositol, 2,3,4,5,6-pentakis(dihydrogen phosphate) 1-(trihydrogen diphosphate)
Diphospho-myo-inositol pentakisphosphate
iphospho-myo-inositol pentakisphosphate

kegg.compound:C11174
keggC:C11174
UPHPWXPNZIOZJL-UOTPTPDRSA-N 		1-Diphosinositol pentakisphosphate
1D-myo-Inositol 1-diphosphate 2,3,4,5,6-pentakisphosphate
D-myo-Inositol, 2,3,4,5,6-pentakis(dihydrogen phosphate) 1-(trihydrogen diphosphate)
Diphospho-myo-inositol pentakisphosphate

CHEBI:62919
chebi:62919
UPHPWXPNZIOZJL-UOTPTPDRSA-N 		1-diphospho-1D-myo-inositol 2,3,4,5,6-pentakisphosphate
(1R,2R,3R,4R,5S,6R)-2,3,4,5,6-pentakis(phosphonooxy)cyclohexyl trihydrogen diphosphate
1-Diphosinositol pentakisphosphate
1-Dpipk
1-PP-IP5
2,3,4,5,6-pentakis-O-phosphono-1D-myo-inositol 1-(trihydrogen diphosphate)
D-myo-Inositol, 2,3,4,5,6-pentakis(dihydrogen phosphate) 1-(trihydrogen diphosphate)
Diphospho-myo-inositol pentakisphosphate
Diphosphoinositol pentakisphosphate
PP-IP(5)

metacyc.compound:CPD-11700
metacycM:CPD-11700
UPHPWXPNZIOZJL-UOTPTPDRSA-A 		1D-myo-inositol 1-diphosphate 2,3,4,5,6-pentakisphosphate
1-diphosinositol pentakisphosphate
1-diphospho-1D-myo-inositol 2,3,4,5,6-pentakisphosphate
1D-myo-inositol 1-diphosphate pentakisphosphate
iphospho-myo-inositol pentakisphosphate

sabiork.compound:13251
sabiorkM:13251
vmhM:dpmipkp
vmhmetabolite:dpmipkp
UPHPWXPNZIOZJL-UOTPTPDRSA-N 		Diphospho-myo-inositol pentakisphosphate

hmdb:HMDB12494
chebi:623
keggC:M_C11174
seedM:M_cpd08050
vmhM:M_dpmipkp 		secondary/obsolete/fantasy identifier