(+)-Glaucarubinone
TL;DR: (+)-Glaucarubinone (CAS 14774-79-9) 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.
[(1S,4R,5R,6R,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] (2S)-2-hydroxy-2-methylbutanoate
Also Known As: (+)-Glaucarubinone, KST-1A1513, (1, A,11, A,12
| Molecular Formula | C25H34O10 |
|---|---|
| Molecular Weight | 494.22 g/mol |
| LogP | 0.1 |
| 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 | 14774-79-9 |
|---|---|
| SMILES | CC[C@@](C)(C(=O)O[C@@H]1C2[C@H]([C@H]([C@]3([C@H]4[C@@]2(CO3)[C@@H](C[C@@H]5[C@@]4([C@@H](C(=O)C=C5C)O)C)OC1=O)O)O)C)O |
| InChIKey | WRBGCYVAJRRQKP-GJIAEIIPSA-N |
Product Overview
(+)-Glaucarubinone (CAS 14774-79-9), with molecular formula C25H34O10 and molecular weight 494.22 g/mol. IUPAC: [(1S,4R,5R,6R,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] (2S)-2-hydroxy-2-methylbutanoate.
Chemical Property Profile of (+)-Glaucarubinone
Property Insights of (+)-Glaucarubinone
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (+)-Glaucarubinone. The TPSA of 160.0 Ų indicates high polarity, suggesting (+)-Glaucarubinone may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, (+)-Glaucarubinone 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 (+)-Glaucarubinone?
The CAS number of (+)-Glaucarubinone is 14774-79-9.
What is the molecular formula of (+)-Glaucarubinone?
The molecular formula of (+)-Glaucarubinone is C25H34O10.
What is the molecular weight of (+)-Glaucarubinone?
The molecular weight of (+)-Glaucarubinone is 494.22 g/mol.
Where can I buy (+)-Glaucarubinone?
You can request a quote for (+)-Glaucarubinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (+)-Glaucarubinone?
Yes, KEHONG BIO provides custom synthesis services for (+)-Glaucarubinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.