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Chemical structure of D-myo-Inositol-1,3,4,6-tetraphosphate (ammonium salt)

GC43517

D-myo-Inositol-1,3,4,6-tetraphosphate (ammonium salt)

Also known as triazanium;azane;[(1R,2R,3S,4S,5S,6R)-2,5-dihydroxy-3-(hydroxy-oxido-oxoniumylidene-lambda5-phosphanyl)oxy-4,6-bis[[hydroxy(oxido)phosphoryl]oxy]cyclohexyl] hydrogen phosphate

The inositol phosphates (IPs) are a family of molecules produced by altering the phosphorylation status of each of the six carbons on the cyclic inositol structure

ChemicalCAS142507-74-2MW568.2FormulaC6H12O18P4•4NH4
CAS number
142507-74-2
Molecular weight
568.2
Formula
C6H12O18P4•4NH4
Solubility
PBS (pH 7·2)： 50 mg/ml,Water： 50 mg/ml
InChIKey
DOJNAPODMFHFNA-ODDQJIBDSA-N
Catalogue number
GC43517
Brand
GLPBIO
Computed properties PubChem CID 176418364 · TPSA 307 Ų · H-bond donors 11 · H-bond acceptors 18
TPSA
307 Ų
H-bond donors
11
H-bond acceptors
18
Rotatable bonds
8
Heavy atoms
32

SMILES [C@@H]1([C@@H]([C@H]([C@H]([C@H]([C@@H]1OP(=O)(O)[O-])OP(=O)(O)[O-])O)OP(=O)(O)[O-])OP(=[OH+])(O)[O-])O.[NH4+].[NH4+].[NH4+].N

Computed descriptors from PubChem (CID 176418364), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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