Stigmasta-5,22-diene-3,7-diol, (3beta,7beta,22E)-
TL;DR: Stigmasta-5,22-diene-3,7-diol, (3beta,7beta,22E)- (CAS 64998-20-5) is a chemical compound with molecular formula C29H48O2 and molecular weight 428.37 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3S,7R,8S,9S,10R,13R,14S,17R)-17-[(E,2R,5S)-5-ethyl-6-methylhept-3-en-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3,7-diol
Also Known As: 7beta-hydroxystigmasterol, 7I(2)-Hydroxystigmasterol, Stigmasta-5,22-diene-3beta,7beta-diol, (22E)-Stigmasta-5,22-diene-3beta,7beta-diol, J1.021.825J
| Molecular Formula | C29H48O2 |
|---|---|
| Molecular Weight | 428.37 g/mol |
| LogP | 6.7716 |
| Topological Polar Surface Area | 40.46 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 428.36542 |
| Heavy Atoms | 31 |
| Complexity | 707.5255 |
Chemical Identifiers
| CAS Number | 64998-20-5 |
|---|---|
| SMILES | CC[C@H](/C=C/[C@@H](C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2[C@H](C=C4[C@@]3(CC[C@@H](C4)O)C)O)C)C(C)C |
Product Overview
Stigmasta-5,22-diene-3,7-diol, (3beta,7beta,22E)- (CAS 64998-20-5), with molecular formula C29H48O2 and molecular weight 428.37 g/mol. IUPAC: (3S,7R,8S,9S,10R,13R,14S,17R)-17-[(E,2R,5S)-5-ethyl-6-methylhept-3-en-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3,7-diol.
Chemical Property Profile of Stigmasta-5,22-diene-3,7-diol, (3beta,7beta,22E)-
Property Insights of Stigmasta-5,22-diene-3,7-diol, (3beta,7beta,22E)-
The XLogP value of 6.7716 indicates that Stigmasta-5,22-diene-3,7-diol, (3beta,7beta,22E)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.46 Ų, Stigmasta-5,22-diene-3,7-diol, (3beta,7beta,22E)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Stigmasta-5,22-diene-3,7-diol, (3beta,7beta,22E)- has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Stigmasta-5,22-diene-3,7-diol, (3beta,7beta,22E)-?
The CAS number of Stigmasta-5,22-diene-3,7-diol, (3beta,7beta,22E)- is 64998-20-5.
What is the molecular formula of Stigmasta-5,22-diene-3,7-diol, (3beta,7beta,22E)-?
The molecular formula of Stigmasta-5,22-diene-3,7-diol, (3beta,7beta,22E)- is C29H48O2.
What is the molecular weight of Stigmasta-5,22-diene-3,7-diol, (3beta,7beta,22E)-?
The molecular weight of Stigmasta-5,22-diene-3,7-diol, (3beta,7beta,22E)- is 428.37 g/mol.
Where can I buy Stigmasta-5,22-diene-3,7-diol, (3beta,7beta,22E)-?
You can request a quote for Stigmasta-5,22-diene-3,7-diol, (3beta,7beta,22E)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Stigmasta-5,22-diene-3,7-diol, (3beta,7beta,22E)-?
Yes, KEHONG BIO provides custom synthesis services for Stigmasta-5,22-diene-3,7-diol, (3beta,7beta,22E)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.