Cercosporin
TL;DR: Cercosporin (CAS 35281-32-4) 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.
7,19-dihydroxy-5,21-bis[(2S)-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, CERCOSPORIN, PURE, 2-(1,3-benzodioxol-5-yl)quinoline, SID:464079054
| 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 | 35281-32-4 |
|---|---|
| SMILES | C[C@@H](CC1=C2C3=C(C(=C(C4=C3C5=C6C2=C(C(=O)C=C6OCOC5=CC4=O)C(=C1OC)O)O)OC)C[C@H](C)O)O |
| InChIKey | MXLWQNCWIIZUQT-QWRGUYRKSA-N |
Product Overview
Cercosporin (CAS 35281-32-4), with molecular formula C29H26O10 and molecular weight 534.15 g/mol. IUPAC: 7,19-dihydroxy-5,21-bis[(2S)-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 Cercosporin
Property Insights of Cercosporin
The XLogP value of 4.0 indicates that Cercosporin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 152.0 Ų indicates high polarity, suggesting Cercosporin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Cercosporin 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 Cercosporin?
The CAS number of Cercosporin is 35281-32-4.
What is the molecular formula of Cercosporin?
The molecular formula of Cercosporin is C29H26O10.
What is the molecular weight of Cercosporin?
The molecular weight of Cercosporin is 534.15 g/mol.
Where can I buy Cercosporin?
You can request a quote for Cercosporin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cercosporin?
Yes, KEHONG BIO provides custom synthesis services for Cercosporin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.