Ergosterone
TL;DR: Ergosterone (CAS 17398-57-1) is a chemical compound with molecular formula C28H42O and molecular weight 394.32 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
17-(5,6-dimethylhept-3-en-2-yl)-10,13-dimethyl-1,2,6,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-one
Also Known As: Ergosterone, Ergosta-4,7,22-trien-3-one, 17-(5,6-dimethylhept-3-en-2-yl)-10,13-dimethyl-1,2,6,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-one
| Molecular Formula | C28H42O |
|---|---|
| Molecular Weight | 394.32 g/mol |
| LogP | 7.1 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 394.32358 |
| Heavy Atoms | 29 |
| Complexity | 752.0 |
Chemical Identifiers
| CAS Number | 17398-57-1 |
|---|---|
| SMILES | CC(C)C(C)C=CC(C)C1CCC2C1(CCC3C2=CCC4=CC(=O)CCC34C)C |
| InChIKey | JBSSIYVUAQDIMG-UHFFFAOYSA-N |
Product Overview
Ergosterone (CAS 17398-57-1), with molecular formula C28H42O and molecular weight 394.32 g/mol. IUPAC: 17-(5,6-dimethylhept-3-en-2-yl)-10,13-dimethyl-1,2,6,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-one.
Chemical Property Profile of Ergosterone
Property Insights of Ergosterone
The XLogP value of 7.1 indicates that Ergosterone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, Ergosterone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ergosterone has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ergosterone?
The CAS number of Ergosterone is 17398-57-1.
What is the molecular formula of Ergosterone?
The molecular formula of Ergosterone is C28H42O.
What is the molecular weight of Ergosterone?
The molecular weight of Ergosterone is 394.32 g/mol.
Where can I buy Ergosterone?
You can request a quote for Ergosterone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ergosterone?
Yes, KEHONG BIO provides custom synthesis services for Ergosterone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.