19-Hydroxycholest-5-en-3-yl acetate
TL;DR: 19-Hydroxycholest-5-en-3-yl acetate (CAS 750-59-4) is a chemical compound with molecular formula C29H48O3 and molecular weight 444.36 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[10-(hydroxymethyl)-13-methyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate
Also Known As: 19-Hydroxycholest-5-en-3-yl acetate, 19-Hydroxycholesteryl acetate, 19-Hydroxycholesterol 3-acetate, 3b-Acetoxycholest-5-en-19-ol, 19-Hydroxy Cholesteryl 3-Acetate
| Molecular Formula | C29H48O3 |
|---|---|
| Molecular Weight | 444.36 g/mol |
| LogP | 7.9 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 444.36035 |
| Heavy Atoms | 32 |
| Complexity | 711.0 |
Chemical Identifiers
| CAS Number | 750-59-4 |
|---|---|
| SMILES | CC(C)CCCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC(=O)C)CO)C |
| InChIKey | ZUYKAEVLUWUNMD-UHFFFAOYSA-N |
Product Overview
19-Hydroxycholest-5-en-3-yl acetate (CAS 750-59-4), with molecular formula C29H48O3 and molecular weight 444.36 g/mol. IUPAC: [10-(hydroxymethyl)-13-methyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate.
Chemical Property Profile of 19-Hydroxycholest-5-en-3-yl acetate
Property Insights of 19-Hydroxycholest-5-en-3-yl acetate
The XLogP value of 7.9 indicates that 19-Hydroxycholest-5-en-3-yl acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.5 Ų, 19-Hydroxycholest-5-en-3-yl acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 19-Hydroxycholest-5-en-3-yl acetate 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 19-Hydroxycholest-5-en-3-yl acetate?
The CAS number of 19-Hydroxycholest-5-en-3-yl acetate is 750-59-4.
What is the molecular formula of 19-Hydroxycholest-5-en-3-yl acetate?
The molecular formula of 19-Hydroxycholest-5-en-3-yl acetate is C29H48O3.
What is the molecular weight of 19-Hydroxycholest-5-en-3-yl acetate?
The molecular weight of 19-Hydroxycholest-5-en-3-yl acetate is 444.36 g/mol.
Where can I buy 19-Hydroxycholest-5-en-3-yl acetate?
You can request a quote for 19-Hydroxycholest-5-en-3-yl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 19-Hydroxycholest-5-en-3-yl acetate?
Yes, KEHONG BIO provides custom synthesis services for 19-Hydroxycholest-5-en-3-yl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.