25-Deoxyecdysone
TL;DR: 25-Deoxyecdysone (CAS 25108-36-5) is a chemical compound with molecular formula C27H44O5 and molecular weight 448.32 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,3R,5R,9R,10R,13R,17R)-2,3,14-trihydroxy-17-[(2S,3R)-3-hydroxy-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,5,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-6-one
Also Known As: 25-Deoxyecdysone, KST-1A3133, KST-1A3134, 2,3,14,22-tetrahydroxycholest-7-en-6-one, (2
| Molecular Formula | C27H44O5 |
|---|---|
| Molecular Weight | 448.32 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 98.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 448.31888 |
| Heavy Atoms | 32 |
| Complexity | 776.0 |
Chemical Identifiers
| CAS Number | 25108-36-5 |
|---|---|
| SMILES | C[C@@H]([C@H]1CCC2([C@@]1(CC[C@H]3C2=CC(=O)[C@H]4[C@@]3(C[C@@H]([C@@H](C4)O)O)C)C)O)[C@@H](CCC(C)C)O |
| InChIKey | HHQGPNBMKUXKRM-BEFWQOHYSA-N |
Product Overview
25-Deoxyecdysone (CAS 25108-36-5), with molecular formula C27H44O5 and molecular weight 448.32 g/mol. IUPAC: (2S,3R,5R,9R,10R,13R,17R)-2,3,14-trihydroxy-17-[(2S,3R)-3-hydroxy-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,5,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-6-one.
Chemical Property Profile of 25-Deoxyecdysone
Property Insights of 25-Deoxyecdysone
The XLogP value of 3.1 indicates that 25-Deoxyecdysone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 25-Deoxyecdysone. Following Lipinski's Rule of Five, 25-Deoxyecdysone has 4 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 25-Deoxyecdysone?
The CAS number of 25-Deoxyecdysone is 25108-36-5.
What is the molecular formula of 25-Deoxyecdysone?
The molecular formula of 25-Deoxyecdysone is C27H44O5.
What is the molecular weight of 25-Deoxyecdysone?
The molecular weight of 25-Deoxyecdysone is 448.32 g/mol.
Where can I buy 25-Deoxyecdysone?
You can request a quote for 25-Deoxyecdysone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 25-Deoxyecdysone?
Yes, KEHONG BIO provides custom synthesis services for 25-Deoxyecdysone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.