网褶菌壳梭菌素醛
TL;DR: 网褶菌壳梭菌素醛 (CAS 5948-43-6) is a chemical compound with molecular formula C20H30O6 and molecular weight 366.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
网褶菌壳梭菌素醛
(4R,9R,10S,12R,13S,14R)-10,12,13,14-tetrahydroxy-5,5,9-trimethyl-11-oxotetracyclo[11.2.1.01,10.04,9]hexadecane-14-carbaldehyde
Also Known As: Phlebiakauranol aldehyde, KST-1A6326, 1H-2,10a-Ethanophenanthrene, kauran-17-al deriv, 11-Oxo-9,12-alpha,13,17-tetrahydroxykauran-17(S)-al, (5
| Molecular Formula | C20H30O6 |
|---|---|
| Molecular Weight | 366.20 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 115.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 366.20422 |
| Heavy Atoms | 26 |
| Complexity | 690.0 |
Chemical Identifiers
| CAS Number | 5948-43-6 |
|---|---|
| SMILES | C[C@@]12CCCC([C@H]1CCC34[C@]2(C(=O)[C@@H]([C@@](C3)([C@](C4)(C=O)O)O)O)O)(C)C |
| InChIKey | YRNWJHCNUMMHJM-NWNIPPRCSA-N |
Product Overview
网褶菌壳梭菌素醛 (CAS 5948-43-6), with molecular formula C20H30O6 and molecular weight 366.20 g/mol. IUPAC: (4R,9R,10S,12R,13S,14R)-10,12,13,14-tetrahydroxy-5,5,9-trimethyl-11-oxotetracyclo[11.2.1.01,10.04,9]hexadecane-14-carbaldehyde.
Chemical Property Profile of 网褶菌壳梭菌素醛
Property Insights of 网褶菌壳梭菌素醛
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 网褶菌壳梭菌素醛. The TPSA of 115.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 网褶菌壳梭菌素醛. Following Lipinski's Rule of Five, 网褶菌壳梭菌素醛 has 4 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 网褶菌壳梭菌素醛?
The CAS number of 网褶菌壳梭菌素醛 is 5948-43-6.
What is the molecular formula of 网褶菌壳梭菌素醛?
The molecular formula of 网褶菌壳梭菌素醛 is C20H30O6.
What is the molecular weight of 网褶菌壳梭菌素醛?
The molecular weight of 网褶菌壳梭菌素醛 is 366.20 g/mol.
Where can I buy 网褶菌壳梭菌素醛?
You can request a quote for 网褶菌壳梭菌素醛 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 网褶菌壳梭菌素醛?
Yes, KEHONG BIO provides custom synthesis services for 网褶菌壳梭菌素醛 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.