Colartin
TL;DR: Colartin (CAS 28443-69-8) is a chemical compound with molecular formula C15H24O3 and molecular weight 252.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3S,3aS,5aR,9R,9aS,9bS)-9-hydroxy-3,5a,9-trimethyl-3a,4,5,6,7,8,9a,9b-octahydro-3H-benzo[g][1]benzofuran-2-one
Also Known As: Colartin, 11,13-Dihydroarbusculin A, KST-1A3455, KST-1A3456, (3s,3as,5ar,9r,9as,9bs)-9-hydroxy-3,5a,9-trimethyldecahydronaphtho[1,2-b]furan-2(3h)-one
| Molecular Formula | C15H24O3 |
|---|---|
| Molecular Weight | 252.17 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 252.17255 |
| Heavy Atoms | 18 |
| Complexity | 380.0 |
Chemical Identifiers
| CAS Number | 28443-69-8 |
|---|---|
| SMILES | C[C@H]1[C@@H]2CC[C@]3(CCC[C@@]([C@@H]3[C@H]2OC1=O)(C)O)C |
| InChIKey | JVVPNUMNEHBXGD-WKKWAXIPSA-N |
Product Overview
Colartin (CAS 28443-69-8), with molecular formula C15H24O3 and molecular weight 252.17 g/mol. IUPAC: (3S,3aS,5aR,9R,9aS,9bS)-9-hydroxy-3,5a,9-trimethyl-3a,4,5,6,7,8,9a,9b-octahydro-3H-benzo[g][1]benzofuran-2-one.
Chemical Property Profile of Colartin
Property Insights of Colartin
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Colartin. With a topological polar surface area (TPSA) of 46.5 Ų, Colartin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Colartin has 1 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 Colartin?
The CAS number of Colartin is 28443-69-8.
What is the molecular formula of Colartin?
The molecular formula of Colartin is C15H24O3.
What is the molecular weight of Colartin?
The molecular weight of Colartin is 252.17 g/mol.
Where can I buy Colartin?
You can request a quote for Colartin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Colartin?
Yes, KEHONG BIO provides custom synthesis services for Colartin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.