Hydroxyarchaetidylinositol
TL;DR: Hydroxyarchaetidylinositol (CAS 134067-43-9) is a chemical compound with molecular formula C49H99O12P and molecular weight 910.69 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2S)-2-[(7R,11R)-3-hydroxy-3,7,11,15-tetramethylhexadecoxy]-3-[(3R,7R,11R)-3,7,11,15-tetramethylhexadecoxy]propyl] [(2S,3R,5S,6S)-2,3,4,5,6-pentahydroxycyclohexyl] hydrogen phosphate
Also Known As: Hydroxyarchaetidylinositol, Hydroxyarchaetidyl-myo-inositol, [(2S)-2-[(7R,11R)-3-hydroxy-3,7,11,15-tetramethylhexadecoxy]-3-[(3R,7R,11R)-3,7,11,15-tetramethylhexadecoxy]propyl] [(2S,3R,5S,6S)-2,3,4,5,6-pentahydroxycyclohexyl] hydrogen phosphate, [(2S)-2-[(7R,11R)-3-hydroxy-3,7,11,15-tetramethylhexadecoxy]-3-[(3R,7R,11R)-3,7,11,15-tetramethylhexadecoxy]propyl] [(2S,3S,5R,6S)-2,3,4,5,6-pentahydroxycyclohexyl] hydrogen phosphate
| Molecular Formula | C49H99O12P |
|---|---|
| Molecular Weight | 910.69 g/mol |
| LogP | 11.8 |
| Topological Polar Surface Area | 196.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 38 |
| Exact Mass | 910.68744 |
| Heavy Atoms | 62 |
| Complexity | 1130.0 |
Chemical Identifiers
| CAS Number | 134067-43-9 |
|---|---|
| SMILES | C[C@H](CCC[C@H](C)CCCC(C)C)CCC[C@@H](C)CCOC[C@@H](COP(=O)(O)OC1[C@H]([C@H](C([C@H]([C@@H]1O)O)O)O)O)OCCC(C)(CCC[C@H](C)CCC[C@H](C)CCCC(C)C)O |
| InChIKey | BIMQTAPDDPVEMF-HDDFTCKKSA-N |
Product Overview
Hydroxyarchaetidylinositol (CAS 134067-43-9), with molecular formula C49H99O12P and molecular weight 910.69 g/mol. IUPAC: [(2S)-2-[(7R,11R)-3-hydroxy-3,7,11,15-tetramethylhexadecoxy]-3-[(3R,7R,11R)-3,7,11,15-tetramethylhexadecoxy]propyl] [(2S,3R,5S,6S)-2,3,4,5,6-pentahydroxycyclohexyl] hydrogen phosphate.
Chemical Property Profile of Hydroxyarchaetidylinositol
Property Insights of Hydroxyarchaetidylinositol
The XLogP value of 11.8 indicates that Hydroxyarchaetidylinositol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 196.0 Ų indicates high polarity, suggesting Hydroxyarchaetidylinositol may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Hydroxyarchaetidylinositol has 7 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Hydroxyarchaetidylinositol?
The CAS number of Hydroxyarchaetidylinositol is 134067-43-9.
What is the molecular formula of Hydroxyarchaetidylinositol?
The molecular formula of Hydroxyarchaetidylinositol is C49H99O12P.
What is the molecular weight of Hydroxyarchaetidylinositol?
The molecular weight of Hydroxyarchaetidylinositol is 910.69 g/mol.
Where can I buy Hydroxyarchaetidylinositol?
You can request a quote for Hydroxyarchaetidylinositol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hydroxyarchaetidylinositol?
Yes, KEHONG BIO provides custom synthesis services for Hydroxyarchaetidylinositol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.