3-Hydroxylanost-8-ene-7,11-dione
TL;DR: 3-Hydroxylanost-8-ene-7,11-dione (CAS 59547-11-4) is a chemical compound with molecular formula C30H48O3 and molecular weight 456.36 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3S,5R,10S,13R,14R,17R)-3-hydroxy-4,4,10,13,14-pentamethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,5,6,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthrene-7,11-dione
Also Known As: 3-Hydroxylanost-8-ene-7,11-dione, KST-1A6340, 3beta-Hydroxylanost-8-ene-7,11-dione, (3, A)-3-hydroxylanost-8-ene-7,11-dione
| Molecular Formula | C30H48O3 |
|---|---|
| Molecular Weight | 456.36 g/mol |
| LogP | 7.5 |
| Topological Polar Surface Area | 54.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 456.36035 |
| Heavy Atoms | 33 |
| Complexity | 866.0 |
Chemical Identifiers
| CAS Number | 59547-11-4 |
|---|---|
| SMILES | C[C@H](CCCC(C)C)[C@H]1CC[C@@]2([C@@]1(CC(=O)C3=C2C(=O)C[C@@H]4[C@@]3(CC[C@@H](C4(C)C)O)C)C)C |
| InChIKey | HWKUGNALHCOUQE-OCBIZMEBSA-N |
Product Overview
3-Hydroxylanost-8-ene-7,11-dione (CAS 59547-11-4), with molecular formula C30H48O3 and molecular weight 456.36 g/mol. IUPAC: (3S,5R,10S,13R,14R,17R)-3-hydroxy-4,4,10,13,14-pentamethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,5,6,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthrene-7,11-dione.
Chemical Property Profile of 3-Hydroxylanost-8-ene-7,11-dione
Property Insights of 3-Hydroxylanost-8-ene-7,11-dione
The XLogP value of 7.5 indicates that 3-Hydroxylanost-8-ene-7,11-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.4 Ų, 3-Hydroxylanost-8-ene-7,11-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Hydroxylanost-8-ene-7,11-dione has 1 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-Hydroxylanost-8-ene-7,11-dione?
The CAS number of 3-Hydroxylanost-8-ene-7,11-dione is 59547-11-4.
What is the molecular formula of 3-Hydroxylanost-8-ene-7,11-dione?
The molecular formula of 3-Hydroxylanost-8-ene-7,11-dione is C30H48O3.
What is the molecular weight of 3-Hydroxylanost-8-ene-7,11-dione?
The molecular weight of 3-Hydroxylanost-8-ene-7,11-dione is 456.36 g/mol.
Where can I buy 3-Hydroxylanost-8-ene-7,11-dione?
You can request a quote for 3-Hydroxylanost-8-ene-7,11-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Hydroxylanost-8-ene-7,11-dione?
Yes, KEHONG BIO provides custom synthesis services for 3-Hydroxylanost-8-ene-7,11-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.