Methyl 3-(acetyloxy)olean-18-en-28-oate
TL;DR: Methyl 3-(acetyloxy)olean-18-en-28-oate (CAS 7235-20-3) is a chemical compound with molecular formula C33H52O4 and molecular weight 512.39 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 10-acetyloxy-2,2,6a,6b,9,9,12a-heptamethyl-3,4,5,6,6a,7,8,8a,10,11,12,13,14,14a-tetradecahydropicene-4a-carboxylate
Also Known As: Methyl 3-(acetyloxy)olean-18-en-28-oate, methyl 10-acetyloxy-2,2,6a,6b,9,9,12a-heptamethyl-3,4,5,6,6a,7,8,8a,10,11,12,13,14,14a-tetradecahydropicene-4a-carboxylate
| Molecular Formula | C33H52O4 |
|---|---|
| Molecular Weight | 512.39 g/mol |
| LogP | 7.8928 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 512.38654 |
| Heavy Atoms | 37 |
| Complexity | 1007.7933 |
Chemical Identifiers
| CAS Number | 7235-20-3 |
|---|---|
| SMILES | CC(=O)OC1CCC2(C3CCC4C5=CC(CCC5(CCC4(C3(CCC2C1(C)C)C)C)C(=O)OC)(C)C)C |
Product Overview
Methyl 3-(acetyloxy)olean-18-en-28-oate (CAS 7235-20-3), with molecular formula C33H52O4 and molecular weight 512.39 g/mol. IUPAC: methyl 10-acetyloxy-2,2,6a,6b,9,9,12a-heptamethyl-3,4,5,6,6a,7,8,8a,10,11,12,13,14,14a-tetradecahydropicene-4a-carboxylate.
Chemical Property Profile of Methyl 3-(acetyloxy)olean-18-en-28-oate
Property Insights of Methyl 3-(acetyloxy)olean-18-en-28-oate
The XLogP value of 7.8928 indicates that Methyl 3-(acetyloxy)olean-18-en-28-oate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, Methyl 3-(acetyloxy)olean-18-en-28-oate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 3-(acetyloxy)olean-18-en-28-oate has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Methyl 3-(acetyloxy)olean-18-en-28-oate?
The CAS number of Methyl 3-(acetyloxy)olean-18-en-28-oate is 7235-20-3.
What is the molecular formula of Methyl 3-(acetyloxy)olean-18-en-28-oate?
The molecular formula of Methyl 3-(acetyloxy)olean-18-en-28-oate is C33H52O4.
What is the molecular weight of Methyl 3-(acetyloxy)olean-18-en-28-oate?
The molecular weight of Methyl 3-(acetyloxy)olean-18-en-28-oate is 512.39 g/mol.
Where can I buy Methyl 3-(acetyloxy)olean-18-en-28-oate?
You can request a quote for Methyl 3-(acetyloxy)olean-18-en-28-oate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 3-(acetyloxy)olean-18-en-28-oate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 3-(acetyloxy)olean-18-en-28-oate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.