Olean-12-ene-3,21,22-triol, (3beta,21beta,22beta)-
TL;DR: Olean-12-ene-3,21,22-triol, (3beta,21beta,22beta)- (CAS 83718-68-7) is a chemical compound with molecular formula C30H50O3 and molecular weight 458.38 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3R,4S,4aR,6aR,6aS,6bR,10S,12aR,14bR)-2,2,4a,6a,6b,9,9,12a-octamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-3,4,10-triol
Also Known As: Olean-12-ene-3,21,22-triol, Olean-12-ene-3,21,22-triol, (3beta,21beta,22beta)-, (5xi)-18alpha-Olean-12-ene-3beta,21beta,22beta-triol, (3R,4S,4aR,6aR,6aS,6bR,10S,12aR,14bR)-2,2,4a,6a,6b,9,9,12a-octamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-3,4,10-triol
| Molecular Formula | C30H50O3 |
|---|---|
| Molecular Weight | 458.38 g/mol |
| LogP | 6.5 |
| Topological Polar Surface Area | 60.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 458.376 |
| Heavy Atoms | 33 |
| Complexity | 859.0 |
Chemical Identifiers
| CAS Number | 83718-68-7 |
|---|---|
| SMILES | C[C@]12CC[C@@H](C(C1CC[C@@]3([C@@H]2CC=C4[C@]3(CC[C@@]5([C@@H]4CC([C@H]([C@H]5O)O)(C)C)C)C)C)(C)C)O |
| InChIKey | KHUOEBOCRCJBCG-SILLFBDBSA-N |
Product Overview
Olean-12-ene-3,21,22-triol, (3beta,21beta,22beta)- (CAS 83718-68-7), with molecular formula C30H50O3 and molecular weight 458.38 g/mol. IUPAC: (3R,4S,4aR,6aR,6aS,6bR,10S,12aR,14bR)-2,2,4a,6a,6b,9,9,12a-octamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-3,4,10-triol.
Chemical Property Profile of Olean-12-ene-3,21,22-triol, (3beta,21beta,22beta)-
Property Insights of Olean-12-ene-3,21,22-triol, (3beta,21beta,22beta)-
The XLogP value of 6.5 indicates that Olean-12-ene-3,21,22-triol, (3beta,21beta,22beta)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Olean-12-ene-3,21,22-triol, (3beta,21beta,22beta)-. Following Lipinski's Rule of Five, Olean-12-ene-3,21,22-triol, (3beta,21beta,22beta)- has 3 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Olean-12-ene-3,21,22-triol, (3beta,21beta,22beta)-?
The CAS number of Olean-12-ene-3,21,22-triol, (3beta,21beta,22beta)- is 83718-68-7.
What is the molecular formula of Olean-12-ene-3,21,22-triol, (3beta,21beta,22beta)-?
The molecular formula of Olean-12-ene-3,21,22-triol, (3beta,21beta,22beta)- is C30H50O3.
What is the molecular weight of Olean-12-ene-3,21,22-triol, (3beta,21beta,22beta)-?
The molecular weight of Olean-12-ene-3,21,22-triol, (3beta,21beta,22beta)- is 458.38 g/mol.
Where can I buy Olean-12-ene-3,21,22-triol, (3beta,21beta,22beta)-?
You can request a quote for Olean-12-ene-3,21,22-triol, (3beta,21beta,22beta)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Olean-12-ene-3,21,22-triol, (3beta,21beta,22beta)-?
Yes, KEHONG BIO provides custom synthesis services for Olean-12-ene-3,21,22-triol, (3beta,21beta,22beta)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.