尾孢菌素
TL;DR: 尾孢菌素 (CAS 35082-49-6) is a chemical compound with molecular formula C29H26O10 and molecular weight 534.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
尾孢菌素
7,19-dihydroxy-5,21-bis(2-hydroxypropyl)-6,20-dimethoxy-12,14-dioxahexacyclo[13.8.0.02,11.03,8.04,22.018,23]tricosa-1,3(8),4,6,10,15,18(23),19,21-nonaene-9,17-dione
Also Known As: CERCOSPORIN, Isocercosporin, iso-Cercosporin, (-)-Isocercosporin, (+)-Cercosporin
| Molecular Formula | C29H26O10 |
|---|---|
| Molecular Weight | 534.15 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 152.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 6 |
| Exact Mass | 534.1526 |
| Heavy Atoms | 39 |
| Complexity | 988.0 |
Chemical Identifiers
| CAS Number | 35082-49-6 |
|---|---|
| SMILES | CC(CC1=C2C3=C(C(=C(C4=C3C5=C6C2=C(C(=O)C=C6OCOC5=CC4=O)C(=C1OC)O)O)OC)CC(C)O)O |
| InChIKey | MXLWQNCWIIZUQT-UHFFFAOYSA-N |
Product Overview
尾孢菌素 (CAS 35082-49-6), with molecular formula C29H26O10 and molecular weight 534.15 g/mol. IUPAC: 7,19-dihydroxy-5,21-bis(2-hydroxypropyl)-6,20-dimethoxy-12,14-dioxahexacyclo[13.8.0.02,11.03,8.04,22.018,23]tricosa-1,3(8),4,6,10,15,18(23),19,21-nonaene-9,17-dione.
Chemical Property Profile of 尾孢菌素
Property Insights of 尾孢菌素
The XLogP value of 4.0 indicates that 尾孢菌素 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 152.0 Ų indicates high polarity, suggesting 尾孢菌素 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 尾孢菌素 has 4 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 尾孢菌素?
The CAS number of 尾孢菌素 is 35082-49-6.
What is the molecular formula of 尾孢菌素?
The molecular formula of 尾孢菌素 is C29H26O10.
What is the molecular weight of 尾孢菌素?
The molecular weight of 尾孢菌素 is 534.15 g/mol.
Where can I buy 尾孢菌素?
You can request a quote for 尾孢菌素 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 尾孢菌素?
Yes, KEHONG BIO provides custom synthesis services for 尾孢菌素 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.