羟基马桑毒素
TL;DR: 羟基马桑毒素 (CAS 2571-22-4) is a chemical compound with molecular formula C15H18O6 and molecular weight 294.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
羟基马桑毒素
(1S,2R,3S,5R,6R,7R,8S,9R,12R)-2,8-dihydroxy-7-methyl-12-prop-1-en-2-ylspiro[4,10-dioxatetracyclo[7.2.1.02,7.03,5]dodecane-6,2'-oxirane]-11-one
Also Known As: Tutin, Tutine, Tutu, Toot poison, Tutinlosung
| Molecular Formula | C15H18O6 |
|---|---|
| Molecular Weight | 294.11 g/mol |
| LogP | -0.5 |
| Topological Polar Surface Area | 91.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 294.11035 |
| Heavy Atoms | 21 |
| Complexity | 603.0 |
Chemical Identifiers
| CAS Number | 2571-22-4 |
|---|---|
| SMILES | CC(=C)[C@@H]1[C@@H]2[C@H]([C@]3([C@@]4(CO4)[C@H]5[C@@H]([C@]3([C@H]1C(=O)O2)O)O5)C)O |
| InChIKey | CCAZWUJBLXKBAY-ULZPOIKGSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
羟基马桑毒素 (CAS 2571-22-4), with molecular formula C15H18O6 and molecular weight 294.11 g/mol. IUPAC: (1S,2R,3S,5R,6R,7R,8S,9R,12R)-2,8-dihydroxy-7-methyl-12-prop-1-en-2-ylspiro[4,10-dioxatetracyclo[7.2.1.02,7.03,5]dodecane-6,2'-oxirane]-11-one.
Chemical Property Profile of 羟基马桑毒素
Property Insights of 羟基马桑毒素
The XLogP value of -0.5 indicates that 羟基马桑毒素 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 91.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 羟基马桑毒素. Following Lipinski's Rule of Five, 羟基马桑毒素 has 2 hydrogen bond donor(s) and 6 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 羟基马桑毒素?
The CAS number of 羟基马桑毒素 is 2571-22-4.
What is the molecular formula of 羟基马桑毒素?
The molecular formula of 羟基马桑毒素 is C15H18O6.
What is the molecular weight of 羟基马桑毒素?
The molecular weight of 羟基马桑毒素 is 294.11 g/mol.
Where can I buy 羟基马桑毒素?
You can request a quote for 羟基马桑毒素 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 羟基马桑毒素?
Yes, KEHONG BIO provides custom synthesis services for 羟基马桑毒素 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.