Actein
TL;DR: Actein (CAS 18642-44-9) is a chemical compound with molecular formula C35H54O9 and molecular weight 618.38 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,3R,4S,5R)-2-[(1R,1'S,4'R,5S,5'R,6'R,10'S,12'S,13'S,16'R,21'R)-2-hydroxy-1,4',6',12',17',17'-hexamethylspiro[3,6-dioxabicyclo[3.1.0]hexane-4,8'-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docosane]-18'-yl]oxyoxane-3,4,5-triol
Also Known As: Actein
| Molecular Formula | C35H54O9 |
|---|---|
| Molecular Weight | 618.38 g/mol |
| LogP | 3.487 |
| Topological Polar Surface Area | 130.37 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 2 |
| Exact Mass | 618.3768 |
| Heavy Atoms | 44 |
| Complexity | 1244.4443 |
Chemical Identifiers
| CAS Number | 18642-44-9 |
|---|---|
| SMILES | C[C@@H]1CC2([C@@H]3[C@@](O3)(C(O2)O)C)O[C@@H]4[C@H]1[C@]5(CC[C@@]67C[C@@]68CCC(C([C@@H]8CC[C@H]7[C@@]5(C4)C)(C)C)O[C@H]9[C@@H]([C@H]([C@@H](CO9)O)O)O)C |
Product Overview
Actein (CAS 18642-44-9), with molecular formula C35H54O9 and molecular weight 618.38 g/mol. IUPAC: (2S,3R,4S,5R)-2-[(1R,1'S,4'R,5S,5'R,6'R,10'S,12'S,13'S,16'R,21'R)-2-hydroxy-1,4',6',12',17',17'-hexamethylspiro[3,6-dioxabicyclo[3.1.0]hexane-4,8'-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docosane]-18'-yl]oxyoxane-3,4,5-triol.
Chemical Property Profile of Actein
Property Insights of Actein
The XLogP value of 3.487 indicates that Actein is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 130.37 Ų falls within the moderate polarity range, balancing permeability and solubility for Actein. Following Lipinski's Rule of Five, Actein has 4 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Actein?
The CAS number of Actein is 18642-44-9.
What is the molecular formula of Actein?
The molecular formula of Actein is C35H54O9.
What is the molecular weight of Actein?
The molecular weight of Actein is 618.38 g/mol.
Where can I buy Actein?
You can request a quote for Actein directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Actein?
Yes, KEHONG BIO provides custom synthesis services for Actein and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.