D-myo-inositol (1,4,5)-trisphosphate
TL;DR: D-myo-inositol (1,4,5)-trisphosphate (CAS 140385-74-6) is a chemical compound with molecular formula C6H9O15P3-6 and molecular weight 413.92 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,3,5-trihydroxy-4,6-diphosphonatooxycyclohexyl) phosphate
Also Known As: D-myo-inositol (1,4,5)-trisphosphate, 3,5,6-triphosphonatooxycyclohexane-1,2,4-triol, D-myo-Inositol 1,3,4-Trisphosphate, Hexapotassium Salt, (2,3,5-trihydroxy-4,6-diphosphonatooxycyclohexyl) phosphate
| Molecular Formula | C6H9O15P3-6 |
|---|---|
| Molecular Weight | 413.92 g/mol |
| LogP | -7.2756 |
| Topological Polar Surface Area | 277.95 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 15 |
| Rotatable Bonds | 6 |
| Exact Mass | 413.91544 |
| Heavy Atoms | 24 |
| Complexity | 573.7585 |
Chemical Identifiers
| CAS Number | 140385-74-6 |
|---|---|
| SMILES | C1(C(C(C(C(C1OP(=O)([O-])[O-])O)OP(=O)([O-])[O-])OP(=O)([O-])[O-])O)O |
Product Overview
D-myo-inositol (1,4,5)-trisphosphate (CAS 140385-74-6), with molecular formula C6H9O15P3-6 and molecular weight 413.92 g/mol. IUPAC: (2,3,5-trihydroxy-4,6-diphosphonatooxycyclohexyl) phosphate.
Chemical Property Profile of D-myo-inositol (1,4,5)-trisphosphate
Property Insights of D-myo-inositol (1,4,5)-trisphosphate
The XLogP value of -7.2756 indicates that D-myo-inositol (1,4,5)-trisphosphate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 277.95 Ų indicates high polarity, suggesting D-myo-inositol (1,4,5)-trisphosphate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, D-myo-inositol (1,4,5)-trisphosphate has 3 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 D-myo-inositol (1,4,5)-trisphosphate?
The CAS number of D-myo-inositol (1,4,5)-trisphosphate is 140385-74-6.
What is the molecular formula of D-myo-inositol (1,4,5)-trisphosphate?
The molecular formula of D-myo-inositol (1,4,5)-trisphosphate is C6H9O15P3-6.
What is the molecular weight of D-myo-inositol (1,4,5)-trisphosphate?
The molecular weight of D-myo-inositol (1,4,5)-trisphosphate is 413.92 g/mol.
Where can I buy D-myo-inositol (1,4,5)-trisphosphate?
You can request a quote for D-myo-inositol (1,4,5)-trisphosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for D-myo-inositol (1,4,5)-trisphosphate?
Yes, KEHONG BIO provides custom synthesis services for D-myo-inositol (1,4,5)-trisphosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.