3,5-Dihydroxyergosta-7,22-dien-6-one
TL;DR: 3,5-Dihydroxyergosta-7,22-dien-6-one (CAS 14858-07-2) is a chemical compound with molecular formula C28H44O3 and molecular weight 428.33 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
17-[(E)-5,6-dimethylhept-3-en-2-yl]-3,5-dihydroxy-10,13-dimethyl-2,3,4,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-6-one
Also Known As: 3,5-Dihydroxyergosta-7,22-dien-6-one, 3,5-Dihydroxy-24-methylcholesta-7,22-dien-6-one, 17-[(E)-5,6-dimethylhept-3-en-2-yl]-3,5-dihydroxy-10,13-dimethyl-2,3,4,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-6-one, (S)-2,3-Dihydroindole-1,2-dicarboxylicacid1-tert-butylester
| Molecular Formula | C28H44O3 |
|---|---|
| Molecular Weight | 428.33 g/mol |
| LogP | 5.7046 |
| Topological Polar Surface Area | 57.53 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 428.32904 |
| Heavy Atoms | 31 |
| Complexity | 781.1271 |
Chemical Identifiers
| CAS Number | 14858-07-2 |
|---|---|
| SMILES | CC(C)C(C)/C=C/C(C)C1CCC2C1(CCC3C2=CC(=O)C4(C3(CCC(C4)O)C)O)C |
Product Overview
3,5-Dihydroxyergosta-7,22-dien-6-one (CAS 14858-07-2), with molecular formula C28H44O3 and molecular weight 428.33 g/mol. IUPAC: 17-[(E)-5,6-dimethylhept-3-en-2-yl]-3,5-dihydroxy-10,13-dimethyl-2,3,4,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-6-one.
Chemical Property Profile of 3,5-Dihydroxyergosta-7,22-dien-6-one
Property Insights of 3,5-Dihydroxyergosta-7,22-dien-6-one
The XLogP value of 5.7046 indicates that 3,5-Dihydroxyergosta-7,22-dien-6-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.53 Ų, 3,5-Dihydroxyergosta-7,22-dien-6-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,5-Dihydroxyergosta-7,22-dien-6-one has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3,5-Dihydroxyergosta-7,22-dien-6-one?
The CAS number of 3,5-Dihydroxyergosta-7,22-dien-6-one is 14858-07-2.
What is the molecular formula of 3,5-Dihydroxyergosta-7,22-dien-6-one?
The molecular formula of 3,5-Dihydroxyergosta-7,22-dien-6-one is C28H44O3.
What is the molecular weight of 3,5-Dihydroxyergosta-7,22-dien-6-one?
The molecular weight of 3,5-Dihydroxyergosta-7,22-dien-6-one is 428.33 g/mol.
Where can I buy 3,5-Dihydroxyergosta-7,22-dien-6-one?
You can request a quote for 3,5-Dihydroxyergosta-7,22-dien-6-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,5-Dihydroxyergosta-7,22-dien-6-one?
Yes, KEHONG BIO provides custom synthesis services for 3,5-Dihydroxyergosta-7,22-dien-6-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.