Dehydroepiandrosterone sulfatide
TL;DR: Dehydroepiandrosterone sulfatide (CAS 79390-57-1) is a chemical compound with molecular formula C54H94O9S and molecular weight 918.66 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-[[(3S,8R,9S,10R,13S,14S)-10,13-dimethyl-17-oxo-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-yl]oxysulfonyloxy]-2-hexadecanoyloxypropyl] hexadecanoate
Also Known As: Dehydroepiandrosterone sulfatide, Dehydroepiandrosterone dipalmitoylglyceride sulfate, Androst-5-en-17-one, 3-(((2,3-bis((1-oxohexadecyl)oxy)propoxy)sulfonyl)oxy)-, (3beta)-, 3-(((2,3-Bis((1-oxohexadecyl)oxy)propoxy)sulfonyl)oxy)androst-5-en-17-one (3beta(R))-, (3beta(R))-3-(((2,3-Bis((1-oxohexadecyl)oxy)propoxy)sulfonyl)oxy)androst-5-en-17-one
| Molecular Formula | C54H94O9S |
|---|---|
| Molecular Weight | 918.66 g/mol |
| LogP | 17.9 |
| Topological Polar Surface Area | 131.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 38 |
| Exact Mass | 918.66187 |
| Heavy Atoms | 64 |
| Complexity | 1490.0 |
Chemical Identifiers
| CAS Number | 79390-57-1 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCC(=O)OCC(COS(=O)(=O)O[C@H]1CC[C@@]2([C@H]3CC[C@]4([C@H]([C@@H]3CC=C2C1)CCC4=O)C)C)OC(=O)CCCCCCCCCCCCCCC |
| InChIKey | BNXZFRVTMCYITG-PZNRALTCSA-N |
Product Overview
Dehydroepiandrosterone sulfatide (CAS 79390-57-1), with molecular formula C54H94O9S and molecular weight 918.66 g/mol. IUPAC: [3-[[(3S,8R,9S,10R,13S,14S)-10,13-dimethyl-17-oxo-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-yl]oxysulfonyloxy]-2-hexadecanoyloxypropyl] hexadecanoate.
Chemical Property Profile of Dehydroepiandrosterone sulfatide
Property Insights of Dehydroepiandrosterone sulfatide
The XLogP value of 17.9 indicates that Dehydroepiandrosterone sulfatide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 131.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Dehydroepiandrosterone sulfatide. Following Lipinski's Rule of Five, Dehydroepiandrosterone sulfatide has 0 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Dehydroepiandrosterone sulfatide?
The CAS number of Dehydroepiandrosterone sulfatide is 79390-57-1.
What is the molecular formula of Dehydroepiandrosterone sulfatide?
The molecular formula of Dehydroepiandrosterone sulfatide is C54H94O9S.
What is the molecular weight of Dehydroepiandrosterone sulfatide?
The molecular weight of Dehydroepiandrosterone sulfatide is 918.66 g/mol.
Where can I buy Dehydroepiandrosterone sulfatide?
You can request a quote for Dehydroepiandrosterone sulfatide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dehydroepiandrosterone sulfatide?
Yes, KEHONG BIO provides custom synthesis services for Dehydroepiandrosterone sulfatide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.