Soularubinone
TL;DR: Soularubinone (CAS 74156-49-3) is a chemical compound with molecular formula C25H34O10 and molecular weight 494.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4,5,17-trihydroxy-6,14,18-trimethyl-9,16-dioxo-3,10-dioxapentacyclo[9.8.0.01,7.04,19.013,18]nonadec-14-en-8-yl) 3-hydroxy-3-methylbutanoate
Also Known As: Soularubinone, (4,5,17-Trihydroxy-6,14,18-trimethyl-9,16-dioxo-3,10-dioxapentacyclo[9.8.0.01,7.04,19.013,18]nonadec-14-en-8-yl) 3-hydroxy-3-methylbutanoate, 1,11,12-Trihydroxy-2,16-dioxo-11,20-epoxypicras-3-en-15-yl 3-hydroxy-3-methylbutanoate, [(1S,4R,5R,6R,7S,8R,11R,13S,17S,18S,19R)-4,5,17-trihydroxy-6,14,18-trimethyl-9,16-dioxo-3,10-dioxapentacyclo[9.8.0.01,7.04,19.013,18]nonadec-14-en-8-yl] 3-hydroxy-3-methylbutanoate
| Molecular Formula | C25H34O10 |
|---|---|
| Molecular Weight | 494.22 g/mol |
| LogP | -0.5 |
| Topological Polar Surface Area | 160.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 4 |
| Exact Mass | 494.2152 |
| Heavy Atoms | 35 |
| Complexity | 1020.0 |
Chemical Identifiers
| CAS Number | 74156-49-3 |
|---|---|
| SMILES | CC1C2C(C(=O)OC3C24COC(C1O)(C4C5(C(C3)C(=CC(=O)C5O)C)C)O)OC(=O)CC(C)(C)O |
| InChIKey | BASHMUPTLJHSQJ-UHFFFAOYSA-N |
Product Overview
Soularubinone (CAS 74156-49-3), with molecular formula C25H34O10 and molecular weight 494.22 g/mol. IUPAC: (4,5,17-trihydroxy-6,14,18-trimethyl-9,16-dioxo-3,10-dioxapentacyclo[9.8.0.01,7.04,19.013,18]nonadec-14-en-8-yl) 3-hydroxy-3-methylbutanoate.
Chemical Property Profile of Soularubinone
Property Insights of Soularubinone
The XLogP value of -0.5 indicates that Soularubinone is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 160.0 Ų indicates high polarity, suggesting Soularubinone may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Soularubinone has 4 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Soularubinone?
The CAS number of Soularubinone is 74156-49-3.
What is the molecular formula of Soularubinone?
The molecular formula of Soularubinone is C25H34O10.
What is the molecular weight of Soularubinone?
The molecular weight of Soularubinone is 494.22 g/mol.
Where can I buy Soularubinone?
You can request a quote for Soularubinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Soularubinone?
Yes, KEHONG BIO provides custom synthesis services for Soularubinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.