Pterosin C
TL;DR: Pterosin C (CAS 40650-74-6) is a chemical compound with molecular formula C14H18O3 and molecular weight 234.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R,3R)-3-hydroxy-6-(2-hydroxyethyl)-2,5,7-trimethyl-2,3-dihydroinden-1-one
Also Known As: Pterosin C, KST-1A4646, (2R-trans)-2,3-Dihydro-3-hydroxy-6-(2-hydroxyethyl)-2,5,7-trimethyl-1H-inden-1-one, (2R,3R)-3-hydroxy-6-(2-hydroxyethyl)-2,5,7-trimethyl-2,3-dihydroinden-1-one, 1H-Inden-1-one, 2,3-dihydro-3-hydroxy-6-(2-hydroxyethyl)-2,5,7-trimethyl-, (2R-trans)-
| Molecular Formula | C14H18O3 |
|---|---|
| Molecular Weight | 234.13 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 57.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 234.1256 |
| Heavy Atoms | 17 |
| Complexity | 302.0 |
Chemical Identifiers
| CAS Number | 40650-74-6 |
|---|---|
| SMILES | C[C@@H]1[C@H](C2=C(C1=O)C(=C(C(=C2)C)CCO)C)O |
| InChIKey | QQPCNRKHGFIVLH-NOZJJQNGSA-N |
Product Overview
Pterosin C (CAS 40650-74-6), with molecular formula C14H18O3 and molecular weight 234.13 g/mol. IUPAC: (2R,3R)-3-hydroxy-6-(2-hydroxyethyl)-2,5,7-trimethyl-2,3-dihydroinden-1-one.
Chemical Property Profile of Pterosin C
Property Insights of Pterosin C
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pterosin C. With a topological polar surface area (TPSA) of 57.5 Ų, Pterosin C exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pterosin C has 2 hydrogen bond donor(s) and 3 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 Pterosin C?
The CAS number of Pterosin C is 40650-74-6.
What is the molecular formula of Pterosin C?
The molecular formula of Pterosin C is C14H18O3.
What is the molecular weight of Pterosin C?
The molecular weight of Pterosin C is 234.13 g/mol.
Where can I buy Pterosin C?
You can request a quote for Pterosin C directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pterosin C?
Yes, KEHONG BIO provides custom synthesis services for Pterosin C and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.