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5-diphospho-1D-myo-inositol 1,3,4,6-tetrakisphosphate

Properties

Image

Occurences in reactions

MNX_ID

MNXM14863

	#reac
in my sandbox	0
in MNXref (generic)	1
in models (compartimentalized)	1

formula

C₆H₇O₂₄P₆

charge

-11

mass

648.78133

reference

chebi:142939

InChIKey

FFZGWHDHUIRNPY-KXXVROSKSA-C

InChI

InChI=1S/C6H18O24P6/c7-1-2(25-31(8,9)10)4(27-33(14,15)16)6(29-36(23,24)30-35(20,21)22)5(28-34(17,18)19)3(1)26-32(11,12)13/h1-7H,(H,23,24)(H2,8,9,10)(H2,11,12,13)(H2,14,15,16)(H2,17,18,19)(H2,20,21,22)/p-11/t1-,2+,3-,4-,5+,6+

SMILES

O=P([O-])([O-])O[C@H]1[C@@H](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:142939 chebi:142939	5-diphospho-1D-myo-inositol 1,3,4,6-tetrakisphosphate 5-PP-InsP4 5-diphospho-1D-myo-inositol 1,3,4,6-tetrakisphosphate(11-)
metacyc.compound:CPD-3843 metacycM:CPD-3843 seed.compound:cpd24456 seedM:cpd24456	1D-myo-inositol 6-diphospho-(1,2,4,5)-tetrakisphosphate 5-PP-InsP4
reactome:R-ALL-1629755 reactomeM:R-ALL-1629755 reactome:R-ALL-2023922 reactomeM:R-ALL-2023922 CHEBI:62928 chebi:62928	5-diphospho-myo-inositol 1,3,4,6-tetrakisphosphate 1,3,4,6-tetrakis-O-phosphono-1D-myo-inositol 5-(trihydrogen diphosphate) 5-PP-IP4
seedM:M_cpd24456	secondary/obsolete/fantasy identifier