Lup-20(29)-en-3-ol
TL;DR: Lup-20(29)-en-3-ol (CAS 4439-99-0) is a chemical compound with molecular formula C30H50O and molecular weight 426.39 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3a,5a,5b,8,8,11a-hexamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysen-9-ol
Also Known As: Lupeol, Fagarasterol, Fagarsterol, Clerodol, Lupenol
| Molecular Formula | C30H50O |
|---|---|
| Molecular Weight | 426.39 g/mol |
| LogP | 9.9 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 426.38617 |
| Heavy Atoms | 31 |
| Complexity | 766.0 |
Chemical Identifiers
| CAS Number | 4439-99-0 |
|---|---|
| SMILES | CC(=C)C1CCC2(C1C3CCC4C5(CCC(C(C5CCC4(C3(CC2)C)C)(C)C)O)C)C |
| InChIKey | MQYXUWHLBZFQQO-UHFFFAOYSA-N |
Product Overview
Lup-20(29)-en-3-ol (CAS 4439-99-0), with molecular formula C30H50O and molecular weight 426.39 g/mol. IUPAC: 3a,5a,5b,8,8,11a-hexamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysen-9-ol.
Chemical Property Profile of Lup-20(29)-en-3-ol
Property Insights of Lup-20(29)-en-3-ol
The XLogP value of 9.9 indicates that Lup-20(29)-en-3-ol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, Lup-20(29)-en-3-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Lup-20(29)-en-3-ol has 1 hydrogen bond donor(s) and 1 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-3-ol?
The CAS number of Lup-20(29)-en-3-ol is 4439-99-0.
What is the molecular formula of Lup-20(29)-en-3-ol?
The molecular formula of Lup-20(29)-en-3-ol is C30H50O.
What is the molecular weight of Lup-20(29)-en-3-ol?
The molecular weight of Lup-20(29)-en-3-ol is 426.39 g/mol.
Where can I buy Lup-20(29)-en-3-ol?
You can request a quote for Lup-20(29)-en-3-ol 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-3-ol?
Yes, KEHONG BIO provides custom synthesis services for Lup-20(29)-en-3-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.