Myo-inositol 1,3,5-trisphosphate
TL;DR: Myo-inositol 1,3,5-trisphosphate (CAS 13090-77-2) is a chemical compound with molecular formula C6H15O15P3 and molecular weight 419.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,4,6-trihydroxy-3,5-diphosphonooxycyclohexyl) dihydrogen phosphate
Also Known As: Inositol 2,4,6-triphosphate, myo-inositol 1,3,5-trisphosphate, Ins(2,4,6)P3, Myo-Ins(2,4,6)P3, inositol-(1,3,5)-triphosphate
| Molecular Formula | C6H15O15P3 |
|---|---|
| Molecular Weight | 419.96 g/mol |
| LogP | -7.0 |
| Topological Polar Surface Area | 261.0 Ų |
| Hydrogen Bond Donors | 9 |
| Hydrogen Bond Acceptors | 15 |
| Rotatable Bonds | 6 |
| Exact Mass | 419.96237 |
| Heavy Atoms | 24 |
| Complexity | 475.0 |
Chemical Identifiers
| CAS Number | 13090-77-2 |
|---|---|
| SMILES | C1(C(C(C(C(C1OP(=O)(O)O)O)OP(=O)(O)O)O)OP(=O)(O)O)O |
| InChIKey | RURWIJNHQMXJDV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Myo-inositol 1,3,5-trisphosphate (CAS 13090-77-2), with molecular formula C6H15O15P3 and molecular weight 419.96 g/mol. IUPAC: (2,4,6-trihydroxy-3,5-diphosphonooxycyclohexyl) dihydrogen phosphate.
Chemical Property Profile of Myo-inositol 1,3,5-trisphosphate
Property Insights of Myo-inositol 1,3,5-trisphosphate
The XLogP value of -7.0 indicates that Myo-inositol 1,3,5-trisphosphate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 261.0 Ų indicates high polarity, suggesting Myo-inositol 1,3,5-trisphosphate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Myo-inositol 1,3,5-trisphosphate has 9 hydrogen bond donor(s) and 15 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Myo-inositol 1,3,5-trisphosphate?
The CAS number of Myo-inositol 1,3,5-trisphosphate is 13090-77-2.
What is the molecular formula of Myo-inositol 1,3,5-trisphosphate?
The molecular formula of Myo-inositol 1,3,5-trisphosphate is C6H15O15P3.
What is the molecular weight of Myo-inositol 1,3,5-trisphosphate?
The molecular weight of Myo-inositol 1,3,5-trisphosphate is 419.96 g/mol.
Where can I buy Myo-inositol 1,3,5-trisphosphate?
You can request a quote for Myo-inositol 1,3,5-trisphosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Myo-inositol 1,3,5-trisphosphate?
Yes, KEHONG BIO provides custom synthesis services for Myo-inositol 1,3,5-trisphosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.