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103476-24-0

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Basic Information
CAS No.: 103476-24-0
Name: D-MYO-INOSITOL 1,4,5-TRISPHOSPHATE HEXAPOTASSIUM SALT
Article Data: 2
Molecular Structure:
Molecular Structure of 103476-24-0 (D-MYO-INOSITOL 1,4,5-TRISPHOSPHATE HEXAPOTASSIUM SALT)
Formula: C6H9K6O15P3
Molecular Weight: 648.64
Synonyms: 1,4,5-IP3, HEXAPOTASSIUM SALT;IP3;IP3 6K;INS(1,4,5)P3 HEXAPOTASSIUM SALT;INS(1,4,5)P3 6K;INS(1,4,5)IP3 (POTASSIUM SALT);INS(1,4,5)P3;D-MYO-INOSITOL 1,4,5-TRIPHOSPHATE HEXAPOTASSIUM SALT
Hazard Symbols: Xi
Risk Codes: 36
Safety: 26
PSA: 307.38000
LogP: -0.85440
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Specification

The D-myo-Inositol,1,4,5-tris(dihydrogen phosphate), hexapotassium salt (9CI), with CAS registry number 103476-24-0, belongs to the following product categories: (1)Inositol Phosphates; (2)Cell Signaling and Neuroscience; (3)Lipids in Cell Signaling; (4)InsP3/Ryanodine receptor. It has the systematic name of hexapotassium (1R,2R,3S,4R,5R,6S)-3,5,6-trihydroxycyclohexane-1,2,4-triyl tris(phosphate). This chemical should be stored at the temperature of −20°C.

Physical properties of D-myo-Inositol,1,4,5-tris(dihydrogen phosphate), hexapotassium salt (9CI): (1)#H bond acceptors: 15; (2)#H bond donors: 9; (3)#Freely Rotating Bonds: 9; (4)Polar Surface Area: 274.38 Å2.

You can still convert the following datas into molecular structure:
(1)SMILES: [K+].[K+].[K+].[K+].[K+].[K+].O=P([O-])([O-])O[C@@H]1[C@@H](O)[C@@H](O)[C@@H](OP([O-])([O-])=O)[C@H](O)[C@H]1OP([O-])([O-])=O
(2)InChI: InChI=1/C6H15O15P3.6K/c7-1-2(8)5(20-23(13,14)15)6(21-24(16,17)18)3(9)4(1)19-22(10,11)12;;;;;;/h1-9H,(H2,10,11,12)(H2,13,14,15)(H2,16,17,18);;;;;;/q;6*+1/p-6/t1-,2+,3+,4-,5-,6-;;;;;;/m1....../s1
(3)InChIKey: DVOPWCOAGWTTEN-TWXSXGSDBA
(4)Std. InChI: InChI=1S/C6H15O15P3.6K/c7-1-2(8)5(20-23(13,14)15)6(21-24(16,17)18)3(9)4(1)19-22(10,11)12;;;;;;/h1-9H,(H2,10,11,12)(H2,13,14,15)(H2,16,17,18);;;;;;/q;6*+1/p-6/t1-,2+,3+,4-,5-,6-;;;;;;/m1....../s1
(5)Std. InChIKey: DVOPWCOAGWTTEN-PPKFVSOLSA-H