From Penicillium roqueforti
TL;DR: From Penicillium roqueforti (CAS 75731-43-0) is a chemical compound with molecular formula C28H35N3O4 and molecular weight 477.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,4,11',11',14'-pentamethylspiro[10H-[1,4]dioxepino[2,3-g]indole-8,12'-3,14-diazatetracyclo[6.5.2.01,10.03,8]pentadecane]-9,15'-dione
Also Known As: Marcfortine A, From Penicillium roqueforti, Alkaloid from Penicillium roqueforti, 4,4,11',11',14'-Pentamethylspiro[10H-[1,4]dioxepino[2,3-g]indole-8,12'-3,14-diazatetracyclo[6.5.2.01,10.03,8]pentadecane]-9,15'-dione
| Molecular Formula | C28H35N3O4 |
|---|---|
| Molecular Weight | 477.26 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 71.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 477.26276 |
| Heavy Atoms | 35 |
| Complexity | 1020.0 |
Chemical Identifiers
| CAS Number | 75731-43-0 |
|---|---|
| SMILES | CC1(C=COC2=C(O1)C=CC3=C2NC(=O)C34CC56CN7CCCCC7(CC5C4(C)C)C(=O)N6C)C |
| InChIKey | KYKUTNUWXQVSSU-UHFFFAOYSA-N |
Product Overview
From Penicillium roqueforti (CAS 75731-43-0), with molecular formula C28H35N3O4 and molecular weight 477.26 g/mol. IUPAC: 4,4,11',11',14'-pentamethylspiro[10H-[1,4]dioxepino[2,3-g]indole-8,12'-3,14-diazatetracyclo[6.5.2.01,10.03,8]pentadecane]-9,15'-dione.
Chemical Property Profile of From Penicillium roqueforti
Property Insights of From Penicillium roqueforti
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for From Penicillium roqueforti. The TPSA of 71.1 Ų falls within the moderate polarity range, balancing permeability and solubility for From Penicillium roqueforti. Following Lipinski's Rule of Five, From Penicillium roqueforti has 1 hydrogen bond donor(s) and 5 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 From Penicillium roqueforti?
The CAS number of From Penicillium roqueforti is 75731-43-0.
What is the molecular formula of From Penicillium roqueforti?
The molecular formula of From Penicillium roqueforti is C28H35N3O4.
What is the molecular weight of From Penicillium roqueforti?
The molecular weight of From Penicillium roqueforti is 477.26 g/mol.
Where can I buy From Penicillium roqueforti?
You can request a quote for From Penicillium roqueforti directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for From Penicillium roqueforti?
Yes, KEHONG BIO provides custom synthesis services for From Penicillium roqueforti and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.