(3beta,5alpha)-Ergosta-8,22-dien-3-ol
TL;DR: (3beta,5alpha)-Ergosta-8,22-dien-3-ol (CAS 6673-68-3) is a chemical compound with molecular formula C28H46O and molecular weight 398.35 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3S,5S,10S,13R,14R,17R)-17-[(E,2R,5R)-5,6-dimethylhept-3-en-2-yl]-10,13-dimethyl-2,3,4,5,6,7,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
Also Known As: delta-8(9),22-Ergostadiene-3beta-ol, 5alpha-ergosta-8,22-dien-3beta-ol, (3beta,5alpha)-ergosta-8,22-dien-3-ol, Ergosta-8,22-dien-3-ol, (3beta,5alpha)-, delta-8(9),22-ergostadiene-3 beta-ol
| Molecular Formula | C28H46O |
|---|---|
| Molecular Weight | 398.35 g/mol |
| LogP | 7.5548 |
| Topological Polar Surface Area | 20.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 398.35486 |
| Heavy Atoms | 29 |
| Complexity | 671.80133 |
Chemical Identifiers
| CAS Number | 6673-68-3 |
|---|---|
| SMILES | C[C@H](/C=C/[C@H](C)C(C)C)[C@H]1CC[C@@H]2[C@@]1(CCC3=C2CC[C@@H]4[C@@]3(CC[C@@H](C4)O)C)C |
Product Overview
(3beta,5alpha)-Ergosta-8,22-dien-3-ol (CAS 6673-68-3), with molecular formula C28H46O and molecular weight 398.35 g/mol. IUPAC: (3S,5S,10S,13R,14R,17R)-17-[(E,2R,5R)-5,6-dimethylhept-3-en-2-yl]-10,13-dimethyl-2,3,4,5,6,7,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol.
Chemical Property Profile of (3beta,5alpha)-Ergosta-8,22-dien-3-ol
Property Insights of (3beta,5alpha)-Ergosta-8,22-dien-3-ol
The XLogP value of 7.5548 indicates that (3beta,5alpha)-Ergosta-8,22-dien-3-ol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.23 Ų, (3beta,5alpha)-Ergosta-8,22-dien-3-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3beta,5alpha)-Ergosta-8,22-dien-3-ol has 1 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 (3beta,5alpha)-Ergosta-8,22-dien-3-ol?
The CAS number of (3beta,5alpha)-Ergosta-8,22-dien-3-ol is 6673-68-3.
What is the molecular formula of (3beta,5alpha)-Ergosta-8,22-dien-3-ol?
The molecular formula of (3beta,5alpha)-Ergosta-8,22-dien-3-ol is C28H46O.
What is the molecular weight of (3beta,5alpha)-Ergosta-8,22-dien-3-ol?
The molecular weight of (3beta,5alpha)-Ergosta-8,22-dien-3-ol is 398.35 g/mol.
Where can I buy (3beta,5alpha)-Ergosta-8,22-dien-3-ol?
You can request a quote for (3beta,5alpha)-Ergosta-8,22-dien-3-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3beta,5alpha)-Ergosta-8,22-dien-3-ol?
Yes, KEHONG BIO provides custom synthesis services for (3beta,5alpha)-Ergosta-8,22-dien-3-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.