alpha-Amyrin palmitate
TL;DR: alpha-Amyrin palmitate (CAS 290299-11-5) is a chemical compound with molecular formula C46H80O2 and molecular weight 664.62 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(3S,6aR,6bS,8aR,11R,12S,12aS,14aR,14bR)-4,4,6a,6b,8a,11,12,14b-octamethyl-2,3,4a,5,6,7,8,9,10,11,12,12a,14,14a-tetradecahydro-1H-picen-3-yl] hexadecanoate
Also Known As: alpha-Amyrin palmitate, alpha-Amyryl hexadecanoate, Urs-12-en-3beta-ol palmitate, Urs-12-en-3-yl hexadecanoatato, KST-1A3161
| Molecular Formula | C46H80O2 |
|---|---|
| Molecular Weight | 664.62 g/mol |
| LogP | 16.9 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 16 |
| Exact Mass | 664.61584 |
| Heavy Atoms | 48 |
| Complexity | 1100.0 |
Chemical Identifiers
| CAS Number | 290299-11-5 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCC(=O)O[C@H]1CC[C@@]2([C@H]3CC=C4[C@H]5[C@H]([C@@H](CC[C@@]5(CC[C@]4([C@@]3(CCC2C1(C)C)C)C)C)C)C)C |
| InChIKey | BHPGRVQWTLDDQX-MYFXNNOVSA-N |
Product Overview
alpha-Amyrin palmitate (CAS 290299-11-5), with molecular formula C46H80O2 and molecular weight 664.62 g/mol. IUPAC: [(3S,6aR,6bS,8aR,11R,12S,12aS,14aR,14bR)-4,4,6a,6b,8a,11,12,14b-octamethyl-2,3,4a,5,6,7,8,9,10,11,12,12a,14,14a-tetradecahydro-1H-picen-3-yl] hexadecanoate.
Chemical Property Profile of alpha-Amyrin palmitate
Property Insights of alpha-Amyrin palmitate
The XLogP value of 16.9 indicates that alpha-Amyrin palmitate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, alpha-Amyrin palmitate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, alpha-Amyrin palmitate has 0 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 alpha-Amyrin palmitate?
The CAS number of alpha-Amyrin palmitate is 290299-11-5.
What is the molecular formula of alpha-Amyrin palmitate?
The molecular formula of alpha-Amyrin palmitate is C46H80O2.
What is the molecular weight of alpha-Amyrin palmitate?
The molecular weight of alpha-Amyrin palmitate is 664.62 g/mol.
Where can I buy alpha-Amyrin palmitate?
You can request a quote for alpha-Amyrin palmitate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for alpha-Amyrin palmitate?
Yes, KEHONG BIO provides custom synthesis services for alpha-Amyrin palmitate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.