Sporidesmin E
TL;DR: Sporidesmin E (CAS 22327-77-1) is a chemical compound with molecular formula C18H20ClN3O6S3 and molecular weight 505.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-chloro-2,3-dihydroxy-7,8-dimethoxy-10,14,19-trimethyl-15,16,17-trithia-10,12,19-triazapentacyclo[12.3.2.01,12.03,11.04,9]nonadeca-4,6,8-triene-13,18-dione
Also Known As: sporidesmin E, isosporidesmin B, (+/-)-SPORIDESMIN E, SPORIDESMIN E, (+/)-, 6-chloro-2,3-dihydroxy-7,8-dimethoxy-10,14,19-trimethyl-15,16,17-trithia-10,12,19-triazapentacyclo[12.3.2.01,12.03,11.04,9]nonadeca-4,6,8-triene-13,18-dione
| Molecular Formula | C18H20ClN3O6S3 |
|---|---|
| Molecular Weight | 505.02 g/mol |
| LogP | 1.4515 |
| Topological Polar Surface Area | 102.78 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 2 |
| Exact Mass | 505.02026 |
| Heavy Atoms | 31 |
| Complexity | 1047.2828 |
Chemical Identifiers
| CAS Number | 22327-77-1 |
|---|---|
| SMILES | CC12C(=O)N3C4C(C(C3(C(=O)N1C)SSS2)O)(C5=CC(=C(C(=C5N4C)OC)OC)Cl)O |
Product Overview
Sporidesmin E (CAS 22327-77-1), with molecular formula C18H20ClN3O6S3 and molecular weight 505.02 g/mol. IUPAC: 6-chloro-2,3-dihydroxy-7,8-dimethoxy-10,14,19-trimethyl-15,16,17-trithia-10,12,19-triazapentacyclo[12.3.2.01,12.03,11.04,9]nonadeca-4,6,8-triene-13,18-dione.
Chemical Property Profile of Sporidesmin E
Property Insights of Sporidesmin E
The XLogP value of 1.4515 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Sporidesmin E. The TPSA of 102.78 Ų falls within the moderate polarity range, balancing permeability and solubility for Sporidesmin E. Following Lipinski's Rule of Five, Sporidesmin E has 2 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 Sporidesmin E?
The CAS number of Sporidesmin E is 22327-77-1.
What is the molecular formula of Sporidesmin E?
The molecular formula of Sporidesmin E is C18H20ClN3O6S3.
What is the molecular weight of Sporidesmin E?
The molecular weight of Sporidesmin E is 505.02 g/mol.
Where can I buy Sporidesmin E?
You can request a quote for Sporidesmin E directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Sporidesmin E?
Yes, KEHONG BIO provides custom synthesis services for Sporidesmin E and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.