Lup-12-en-3-ol, (3beta,18beta,19beta)-
TL;DR: Lup-12-en-3-ol, (3beta,18beta,19beta)- (CAS 74523-79-8) 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.
(1R,3aR,5aS,5bR,7aR,9S,11aR,11bR,13bR)-3a,5a,5b,8,8,11a-hexamethyl-1-propan-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13b-tetradecahydrocyclopenta[a]chrysen-9-ol
Also Known As: Neolupenol, Lup-12-en-3-ol, Lup-12-en-3-ol, (3beta,18beta,19beta)-, 18beta,19beta-Lup-12-en-3beta-ol, (18R,19R)-Lup-12-en-3beta-ol
| Molecular Formula | C30H50O |
|---|---|
| Molecular Weight | 426.39 g/mol |
| LogP | 9.0 |
| 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 | 777.0 |
Chemical Identifiers
| CAS Number | 74523-79-8 |
|---|---|
| SMILES | CC(C)[C@H]1CC[C@]2([C@@H]1C3=CC[C@@H]4[C@]5(CC[C@@H](C([C@@H]5CC[C@]4([C@@]3(CC2)C)C)(C)C)O)C)C |
| InChIKey | LSACXWBGTOJFEP-DXGONMJDSA-N |
Product Overview
Lup-12-en-3-ol, (3beta,18beta,19beta)- (CAS 74523-79-8), with molecular formula C30H50O and molecular weight 426.39 g/mol. IUPAC: (1R,3aR,5aS,5bR,7aR,9S,11aR,11bR,13bR)-3a,5a,5b,8,8,11a-hexamethyl-1-propan-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13b-tetradecahydrocyclopenta[a]chrysen-9-ol.
Chemical Property Profile of Lup-12-en-3-ol, (3beta,18beta,19beta)-
Property Insights of Lup-12-en-3-ol, (3beta,18beta,19beta)-
The XLogP value of 9.0 indicates that Lup-12-en-3-ol, (3beta,18beta,19beta)- 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-12-en-3-ol, (3beta,18beta,19beta)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Lup-12-en-3-ol, (3beta,18beta,19beta)- 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-12-en-3-ol, (3beta,18beta,19beta)-?
The CAS number of Lup-12-en-3-ol, (3beta,18beta,19beta)- is 74523-79-8.
What is the molecular formula of Lup-12-en-3-ol, (3beta,18beta,19beta)-?
The molecular formula of Lup-12-en-3-ol, (3beta,18beta,19beta)- is C30H50O.
What is the molecular weight of Lup-12-en-3-ol, (3beta,18beta,19beta)-?
The molecular weight of Lup-12-en-3-ol, (3beta,18beta,19beta)- is 426.39 g/mol.
Where can I buy Lup-12-en-3-ol, (3beta,18beta,19beta)-?
You can request a quote for Lup-12-en-3-ol, (3beta,18beta,19beta)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Lup-12-en-3-ol, (3beta,18beta,19beta)-?
Yes, KEHONG BIO provides custom synthesis services for Lup-12-en-3-ol, (3beta,18beta,19beta)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.