Stypotriol
TL;DR: Stypotriol (CAS 71106-25-7) is a chemical compound with molecular formula C27H40O4 and molecular weight 428.29 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,4aS,4bR,7S,10aR)-1,1,4a,7,7',8a-hexamethylspiro[2,3,4,4b,5,6,7,9,10,10a-decahydrophenanthrene-8,2'-3H-1-benzofuran]-2,4',5'-triol
Also Known As: Stypotriol, Stypotriol triacetate, (2'S,4'aR,4'bS,7'S,8'aR)-2',4'b,7,8',8',10'a-Hexamethyl-3',4',4'a,4'b,5',6',7',8',8'a,9',10',10'a-dodecahydro-2'H,3H-spiro[[1]benzofuran-2,1'-phenanthrene]-4,5,7'-triol, (2S,4aS,4bR,7S,10aR)-1,1,4a,7,7',8a-hexamethylspiro[2,3,4,4b,5,6,7,9,10,10a-decahydrophenanthrene-8,2'-3H-1-benzofuran]-2,4',5'-triol, 2',4'b,7,8',8',10'a-Hexamethyl-3',4',4'a,4'b,5',6',7',8',8'a,9',10',10'a-dodecahydro-2'H,3H-spiro[1-benzofuran-2,1'-phenanthrene]-4,5,7'-triol
| Molecular Formula | C27H40O4 |
|---|---|
| Molecular Weight | 428.29 g/mol |
| LogP | 6.5 |
| Topological Polar Surface Area | 69.9 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 428.29266 |
| Heavy Atoms | 31 |
| Complexity | 722.0 |
Chemical Identifiers
| CAS Number | 71106-25-7 |
|---|---|
| SMILES | C[C@H]1CC[C@@H]2[C@]3(CC[C@@H](C([C@@H]3CCC2(C14CC5=C(O4)C(=CC(=C5O)O)C)C)(C)C)O)C |
| InChIKey | HJSZCMVJNUBOQM-ALIOYUSOSA-N |
Product Overview
Stypotriol (CAS 71106-25-7), with molecular formula C27H40O4 and molecular weight 428.29 g/mol. IUPAC: (2S,4aS,4bR,7S,10aR)-1,1,4a,7,7',8a-hexamethylspiro[2,3,4,4b,5,6,7,9,10,10a-decahydrophenanthrene-8,2'-3H-1-benzofuran]-2,4',5'-triol.
Chemical Property Profile of Stypotriol
Property Insights of Stypotriol
The XLogP value of 6.5 indicates that Stypotriol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Stypotriol. Following Lipinski's Rule of Five, Stypotriol has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Stypotriol?
The CAS number of Stypotriol is 71106-25-7.
What is the molecular formula of Stypotriol?
The molecular formula of Stypotriol is C27H40O4.
What is the molecular weight of Stypotriol?
The molecular weight of Stypotriol is 428.29 g/mol.
Where can I buy Stypotriol?
You can request a quote for Stypotriol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Stypotriol?
Yes, KEHONG BIO provides custom synthesis services for Stypotriol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.