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

Properties

Image

Occurences in reactions

MNX_ID

MNXM1364366

	#reac
in my sandbox	0
in MNXref (generic)	5
in models (compartimentalized)	0

formula

C₆H₆O₂₇P₇

charge

-13

mass

726.898

reference

metacycM:CPD-11700

InChIKey

UPHPWXPNZIOZJL-UHFFFAOYSA-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

SMILES

[CH:1]1([O:27][P:34]([OH:7])([OH:8])=[O:9])[CH:2]([O:28][P:35]([OH:10])([OH:11])=[O:12])[CH:4]([O:30][P:37]([OH:16])([OH:17])=[O:18])[CH:6]([O:32][P:40]([OH:25])(=[O:26])[O:33][P:39]([OH:22])([OH:23])=[O:24])[CH:5]([O:31][P:38]([OH:19])([OH:20])=[O:21])[CH:3]1[O:29][P:36]([OH:13])([OH:14])=[O:15]

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
metacyc.compound:CPD-11700 metacycM:CPD-11700	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
metacyc.compound:CPD-11937 metacycM:CPD-11937	1D-myo-inositol 3-diphosphate 1,2,4,5,6-pentakisphosphate 3-PP-InsP5 3-diphospho-1D-myo-inositol 1,2,4,5,6-pentakisphosphate 3-diphospho-1D-myo-inositol pentakisphosphate
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
metacyc.compound:CPD-11701 metacycM:CPD-11701	4-diphospho-1D-myo-inositol (1,2,3,5,6)pentakisphosphate
metacyc.compound:CPD-11702 metacycM:CPD-11702	6-diphospho-1D-myo-inositol (1,2,3,4,5)pentakisphosphate
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
seedM:M_cpd36883	secondary/obsolete/fantasy identifier