3beta-Hydroxytaraxast-20-en-16-one
TL;DR: 3beta-Hydroxytaraxast-20-en-16-one (CAS 42482-69-9) is a chemical compound with molecular formula C30H48O2 and molecular weight 440.37 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
10-hydroxy-1,2,4a,6a,6b,9,9,12a-octamethyl-1,4,6,6a,7,8,8a,10,11,12,13,14,14a,14b-tetradecahydropicen-5-one
Also Known As: 3-Hydroxyurs-20-en-16-one, 3-Hydroxyurs-20-en-16-one #, 3beta-Hydroxytaraxast-20-en-16-one, Urs-20-en-16-one, 3-hydroxy-, (3.beta.,18.alpha.,19.alpha.)-, 10-hydroxy-1,2,4a,6a,6b,9,9,12a-octamethyl-1,4,6,6a,7,8,8a,10,11,12,13,14,14a,14b-tetradecahydropicen-5-one
| Molecular Formula | C30H48O2 |
|---|---|
| Molecular Weight | 440.37 g/mol |
| LogP | 7.2 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 440.36542 |
| Heavy Atoms | 32 |
| Complexity | 855.0 |
Chemical Identifiers
| CAS Number | 42482-69-9 |
|---|---|
| SMILES | CC1C2C3CCC4C5(CCC(C(C5CCC4(C3(CC(=O)C2(CC=C1C)C)C)C)(C)C)O)C |
| InChIKey | KITFRXICXBNQTD-UHFFFAOYSA-N |
Product Overview
3beta-Hydroxytaraxast-20-en-16-one (CAS 42482-69-9), with molecular formula C30H48O2 and molecular weight 440.37 g/mol. IUPAC: 10-hydroxy-1,2,4a,6a,6b,9,9,12a-octamethyl-1,4,6,6a,7,8,8a,10,11,12,13,14,14a,14b-tetradecahydropicen-5-one.
Chemical Property Profile of 3beta-Hydroxytaraxast-20-en-16-one
Property Insights of 3beta-Hydroxytaraxast-20-en-16-one
The XLogP value of 7.2 indicates that 3beta-Hydroxytaraxast-20-en-16-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, 3beta-Hydroxytaraxast-20-en-16-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3beta-Hydroxytaraxast-20-en-16-one has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3beta-Hydroxytaraxast-20-en-16-one?
The CAS number of 3beta-Hydroxytaraxast-20-en-16-one is 42482-69-9.
What is the molecular formula of 3beta-Hydroxytaraxast-20-en-16-one?
The molecular formula of 3beta-Hydroxytaraxast-20-en-16-one is C30H48O2.
What is the molecular weight of 3beta-Hydroxytaraxast-20-en-16-one?
The molecular weight of 3beta-Hydroxytaraxast-20-en-16-one is 440.37 g/mol.
Where can I buy 3beta-Hydroxytaraxast-20-en-16-one?
You can request a quote for 3beta-Hydroxytaraxast-20-en-16-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3beta-Hydroxytaraxast-20-en-16-one?
Yes, KEHONG BIO provides custom synthesis services for 3beta-Hydroxytaraxast-20-en-16-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.