Lup-20(29)-en-28-al, 3-hydroxy-, (3alpha)-
TL;DR: Lup-20(29)-en-28-al, 3-hydroxy-, (3alpha)- (CAS 92594-07-5) 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.
(1R,3aS,5aR,5bR,7aR,9R,11aR,11bR,13aR,13bR)-9-hydroxy-5a,5b,8,8,11a-pentamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-3a-carbaldehyde
Also Known As: 3-Epibetulinic aldehyde, 3-epi-betulinaldehyde, Lup-20(29)-en-28-al, 3-hydroxy-, (3alpha)-, 3-hydroxylup-20(29)-en-28-al, FL 155
| Molecular Formula | C30H48O2 |
|---|---|
| Molecular Weight | 440.37 g/mol |
| LogP | 8.1 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 440.36542 |
| Heavy Atoms | 32 |
| Complexity | 814.0 |
Chemical Identifiers
| CAS Number | 92594-07-5 |
|---|---|
| SMILES | CC(=C)[C@@H]1CC[C@]2([C@H]1[C@H]3CC[C@@H]4[C@]5(CC[C@H](C([C@@H]5CC[C@]4([C@@]3(CC2)C)C)(C)C)O)C)C=O |
| InChIKey | FELCJAPFJOPHSD-PGROKZIJSA-N |
Product Overview
Lup-20(29)-en-28-al, 3-hydroxy-, (3alpha)- (CAS 92594-07-5), with molecular formula C30H48O2 and molecular weight 440.37 g/mol. IUPAC: (1R,3aS,5aR,5bR,7aR,9R,11aR,11bR,13aR,13bR)-9-hydroxy-5a,5b,8,8,11a-pentamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-3a-carbaldehyde.
Chemical Property Profile of Lup-20(29)-en-28-al, 3-hydroxy-, (3alpha)-
Property Insights of Lup-20(29)-en-28-al, 3-hydroxy-, (3alpha)-
The XLogP value of 8.1 indicates that Lup-20(29)-en-28-al, 3-hydroxy-, (3alpha)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, Lup-20(29)-en-28-al, 3-hydroxy-, (3alpha)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Lup-20(29)-en-28-al, 3-hydroxy-, (3alpha)- 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 Lup-20(29)-en-28-al, 3-hydroxy-, (3alpha)-?
The CAS number of Lup-20(29)-en-28-al, 3-hydroxy-, (3alpha)- is 92594-07-5.
What is the molecular formula of Lup-20(29)-en-28-al, 3-hydroxy-, (3alpha)-?
The molecular formula of Lup-20(29)-en-28-al, 3-hydroxy-, (3alpha)- is C30H48O2.
What is the molecular weight of Lup-20(29)-en-28-al, 3-hydroxy-, (3alpha)-?
The molecular weight of Lup-20(29)-en-28-al, 3-hydroxy-, (3alpha)- is 440.37 g/mol.
Where can I buy Lup-20(29)-en-28-al, 3-hydroxy-, (3alpha)-?
You can request a quote for Lup-20(29)-en-28-al, 3-hydroxy-, (3alpha)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Lup-20(29)-en-28-al, 3-hydroxy-, (3alpha)-?
Yes, KEHONG BIO provides custom synthesis services for Lup-20(29)-en-28-al, 3-hydroxy-, (3alpha)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.