CID 47926
TL;DR: CID 47926 (CAS 66419-08-7) is a chemical compound with molecular formula C29H40O9 and molecular weight 532.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1S,3R,8R,10S,12R,14S,18R,19R,22S)-5,7,22-trihydroxy-8,14,18-trimethyl-19-(5-oxo-2H-furan-3-yl)-4,9,11-trioxahexacyclo[12.11.0.03,12.05,10.015,23.018,22]pentacosan-6-one
Also Known As: Labriformidin, (1S,3R,8R,10S,12R,14S,18R,19R,22S)-5,7,22-Trihydroxy-8,14,18-trimethyl-19-(5-oxo-2H-furan-3-yl)-4,9,11-trioxahexacyclo[12.11.0.03,12.05,10.015,23.018,22]pentacosan-6-one, Card-20(22)-enolide, 14-hydroxy-2,3-((tetrahydro-3,5-dihydroxy-6-methyl-4-oxo-2H-pyran-3,2-diyl)bis(oxy))-, (2-alpha(2S,6R),3-beta,5-alpha)-
| Molecular Formula | C29H40O9 |
|---|---|
| Molecular Weight | 532.27 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 132.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 1 |
| Exact Mass | 532.2672 |
| Heavy Atoms | 38 |
| Complexity | 1090.0 |
Chemical Identifiers
| CAS Number | 66419-08-7 |
|---|---|
| SMILES | C[C@@H]1C(C(=O)C2([C@@H](O1)O[C@@H]3C[C@]4([C@@H](CCC5C4CC[C@]6([C@@]5(CC[C@@H]6C7=CC(=O)OC7)O)C)C[C@H]3O2)C)O)O |
| InChIKey | RHGBGBRWSIVZTH-FNFICDQQSA-N |
Product Overview
CID 47926 (CAS 66419-08-7), with molecular formula C29H40O9 and molecular weight 532.27 g/mol. IUPAC: (1S,3R,8R,10S,12R,14S,18R,19R,22S)-5,7,22-trihydroxy-8,14,18-trimethyl-19-(5-oxo-2H-furan-3-yl)-4,9,11-trioxahexacyclo[12.11.0.03,12.05,10.015,23.018,22]pentacosan-6-one.
Chemical Property Profile of CID 47926
Property Insights of CID 47926
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CID 47926. The TPSA of 132.0 Ų falls within the moderate polarity range, balancing permeability and solubility for CID 47926. Following Lipinski's Rule of Five, CID 47926 has 3 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of CID 47926?
The CAS number of CID 47926 is 66419-08-7.
What is the molecular formula of CID 47926?
The molecular formula of CID 47926 is C29H40O9.
What is the molecular weight of CID 47926?
The molecular weight of CID 47926 is 532.27 g/mol.
Where can I buy CID 47926?
You can request a quote for CID 47926 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CID 47926?
Yes, KEHONG BIO provides custom synthesis services for CID 47926 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.