myo-Inositol, 1-(2-methoxy-3-(octadecyloxy)propyl hydrogen phosphate)
TL;DR: myo-Inositol, 1-(2-methoxy-3-(octadecyloxy)propyl hydrogen phosphate) (CAS 90366-45-3) is a chemical compound with molecular formula C28H57O11P and molecular weight 600.36 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-methoxy-3-octadecoxypropyl) [(2S,3R,5S,6S)-2,3,4,5,6-pentahydroxycyclohexyl] hydrogen phosphate
Also Known As: myo-Inositol, 1-(2-methoxy-3-(octadecyloxy)propyl hydrogen phosphate), 2-Methoxy-3-(octadecyloxy)propyl 2,3,4,5,6-pentahydroxycyclohexyl hydrogen phosphate, (2-methoxy-3-octadecoxypropyl) [(2S,3R,5S,6S)-2,3,4,5,6-pentahydroxycyclohexyl] hydrogen phosphate, 2-methoxy-3-(octadecyloxy)propyl (2S,3R,5S,6S)-2,3,4,5,6-pentahydroxycyclohexyl hydrogen phosphate
| Molecular Formula | C28H57O11P |
|---|---|
| Molecular Weight | 600.36 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 175.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 25 |
| Exact Mass | 600.36383 |
| Heavy Atoms | 40 |
| Complexity | 640.0 |
Chemical Identifiers
| CAS Number | 90366-45-3 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCCOCC(COP(=O)(O)OC1[C@H]([C@H](C([C@H]([C@@H]1O)O)O)O)O)OC |
| InChIKey | DCTHFLQQSOZFLG-ZLKMSFMRSA-N |
Product Overview
myo-Inositol, 1-(2-methoxy-3-(octadecyloxy)propyl hydrogen phosphate) (CAS 90366-45-3), with molecular formula C28H57O11P and molecular weight 600.36 g/mol. IUPAC: (2-methoxy-3-octadecoxypropyl) [(2S,3R,5S,6S)-2,3,4,5,6-pentahydroxycyclohexyl] hydrogen phosphate.
Chemical Property Profile of myo-Inositol, 1-(2-methoxy-3-(octadecyloxy)propyl hydrogen phosphate)
Property Insights of myo-Inositol, 1-(2-methoxy-3-(octadecyloxy)propyl hydrogen phosphate)
The XLogP value of 4.3 indicates that myo-Inositol, 1-(2-methoxy-3-(octadecyloxy)propyl hydrogen phosphate) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 175.0 Ų indicates high polarity, suggesting myo-Inositol, 1-(2-methoxy-3-(octadecyloxy)propyl hydrogen phosphate) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, myo-Inositol, 1-(2-methoxy-3-(octadecyloxy)propyl hydrogen phosphate) has 6 hydrogen bond donor(s) and 11 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-(2-methoxy-3-(octadecyloxy)propyl hydrogen phosphate)?
The CAS number of myo-Inositol, 1-(2-methoxy-3-(octadecyloxy)propyl hydrogen phosphate) is 90366-45-3.
What is the molecular formula of myo-Inositol, 1-(2-methoxy-3-(octadecyloxy)propyl hydrogen phosphate)?
The molecular formula of myo-Inositol, 1-(2-methoxy-3-(octadecyloxy)propyl hydrogen phosphate) is C28H57O11P.
What is the molecular weight of myo-Inositol, 1-(2-methoxy-3-(octadecyloxy)propyl hydrogen phosphate)?
The molecular weight of myo-Inositol, 1-(2-methoxy-3-(octadecyloxy)propyl hydrogen phosphate) is 600.36 g/mol.
Where can I buy myo-Inositol, 1-(2-methoxy-3-(octadecyloxy)propyl hydrogen phosphate)?
You can request a quote for myo-Inositol, 1-(2-methoxy-3-(octadecyloxy)propyl hydrogen phosphate) 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-(2-methoxy-3-(octadecyloxy)propyl hydrogen phosphate)?
Yes, KEHONG BIO provides custom synthesis services for myo-Inositol, 1-(2-methoxy-3-(octadecyloxy)propyl hydrogen phosphate) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.