(+)-Decursinol
TL;DR: (+)-Decursinol (CAS 23458-02-8) is a chemical compound with molecular formula C14H14O4 and molecular weight 246.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3S)-3-hydroxy-2,2-dimethyl-3,4-dihydropyrano[3,2-g]chromen-8-one
Also Known As: Decursinol, (+)-Decursinol, Smyrinol, Smirino, SFE decursinol
| Molecular Formula | C14H14O4 |
|---|---|
| Molecular Weight | 246.09 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 55.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 246.0892 |
| Heavy Atoms | 18 |
| Complexity | 387.0 |
Chemical Identifiers
| CAS Number | 23458-02-8 |
|---|---|
| SMILES | CC1([C@H](CC2=C(O1)C=C3C(=C2)C=CC(=O)O3)O)C |
| InChIKey | BGXFQDFSVDZUIW-LBPRGKRZSA-N |
Product Overview
(+)-Decursinol (CAS 23458-02-8), with molecular formula C14H14O4 and molecular weight 246.09 g/mol. IUPAC: (3S)-3-hydroxy-2,2-dimethyl-3,4-dihydropyrano[3,2-g]chromen-8-one.
Chemical Property Profile of (+)-Decursinol
Property Insights of (+)-Decursinol
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (+)-Decursinol. With a topological polar surface area (TPSA) of 55.8 Ų, (+)-Decursinol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (+)-Decursinol 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 (+)-Decursinol?
The CAS number of (+)-Decursinol is 23458-02-8.
What is the molecular formula of (+)-Decursinol?
The molecular formula of (+)-Decursinol is C14H14O4.
What is the molecular weight of (+)-Decursinol?
The molecular weight of (+)-Decursinol is 246.09 g/mol.
Where can I buy (+)-Decursinol?
You can request a quote for (+)-Decursinol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (+)-Decursinol?
Yes, KEHONG BIO provides custom synthesis services for (+)-Decursinol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.