Geigerin
TL;DR: Geigerin (CAS 436-45-3) is a chemical compound with molecular formula C15H20O4 and molecular weight 264.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1R,3aR,5S,5aR,9S,9aS)-9-hydroxy-1,5,8-trimethyl-1,3a,4,5,5a,6,9,9a-octahydroazuleno[6,5-b]furan-2,7-dione
Also Known As: Geigerin, KST-1A4954, ( inverted exclamation markA)-geigerin, (1R,3aR,5S,5aR,9S,9aS)-9-hydroxy-1,5,8-trimethyl-1,3a,4,5,5a,6,9,9a-octahydroazuleno[6,5-b]furan-2,7-dione, (3r,3as,4s,7ar,8s,9ar)-4-hydroxy-3,5,8-trimethyl-3a,7,7a,8,9,9a-hexahydroazuleno[6,5-b]furan-2,6(3h,4h)-dione
| Molecular Formula | C15H20O4 |
|---|---|
| Molecular Weight | 264.14 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 264.13617 |
| Heavy Atoms | 19 |
| Complexity | 479.0 |
Chemical Identifiers
| CAS Number | 436-45-3 |
|---|---|
| SMILES | C[C@H]1C[C@@H]2[C@@H]([C@H](C(=O)O2)C)[C@@H](C3=C(C(=O)C[C@H]13)C)O |
| InChIKey | BFWXQSLJSDLIAA-IHVHESTJSA-N |
Product Overview
Geigerin (CAS 436-45-3), with molecular formula C15H20O4 and molecular weight 264.14 g/mol. IUPAC: (1R,3aR,5S,5aR,9S,9aS)-9-hydroxy-1,5,8-trimethyl-1,3a,4,5,5a,6,9,9a-octahydroazuleno[6,5-b]furan-2,7-dione.
Chemical Property Profile of Geigerin
Property Insights of Geigerin
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Geigerin. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Geigerin. Following Lipinski's Rule of Five, Geigerin has 1 hydrogen bond donor(s) and 4 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 Geigerin?
The CAS number of Geigerin is 436-45-3.
What is the molecular formula of Geigerin?
The molecular formula of Geigerin is C15H20O4.
What is the molecular weight of Geigerin?
The molecular weight of Geigerin is 264.14 g/mol.
Where can I buy Geigerin?
You can request a quote for Geigerin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Geigerin?
Yes, KEHONG BIO provides custom synthesis services for Geigerin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.