糖松酸
TL;DR: 糖松酸 (CAS 5447-52-9) is a chemical compound with molecular formula C20H28O3 and molecular weight 316.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
糖松酸
methyl (1S,4aR,5S,8aR)-5-[2-(furan-3-yl)ethyl]-4a-methyl-6-methylidene-1,2,3,4,5,7,8,8a-octahydronaphthalene-1-carboxylate
Also Known As: Lambertianic acid, Lambertian acid, methyl (1S,4aR,5S,8aR)-5-[2-(furan-3-yl)ethyl]-4a-methyl-6-methylidene-1,2,3,4,5,7,8,8a-octahydronaphthalene-1-carboxylate, (1S,4aR,5R)-5-(2-(furan-3-yl)ethyl)-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid, methyl (1S,4aR,5S,8aR)-5-(2-(furan-3-yl)ethyl)-4a-methyl-6-methylenedecahydronaphthalene-1-carboxylate
| Molecular Formula | C20H28O3 |
|---|---|
| Molecular Weight | 316.20 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 39.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 316.20386 |
| Heavy Atoms | 23 |
| Complexity | 458.0 |
Chemical Identifiers
| CAS Number | 5447-52-9 |
|---|---|
| SMILES | C[C@@]12CCC[C@@H]([C@H]1CCC(=C)[C@@H]2CCC3=COC=C3)C(=O)OC |
| InChIKey | XZOUFGJMCGQXNM-GNBUJSLZSA-N |
Product Overview
糖松酸 (CAS 5447-52-9), with molecular formula C20H28O3 and molecular weight 316.20 g/mol. IUPAC: methyl (1S,4aR,5S,8aR)-5-[2-(furan-3-yl)ethyl]-4a-methyl-6-methylidene-1,2,3,4,5,7,8,8a-octahydronaphthalene-1-carboxylate.
Chemical Property Profile of 糖松酸
Property Insights of 糖松酸
The XLogP value of 4.9 indicates that 糖松酸 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 39.4 Ų, 糖松酸 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 糖松酸 has 0 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 糖松酸?
The CAS number of 糖松酸 is 5447-52-9.
What is the molecular formula of 糖松酸?
The molecular formula of 糖松酸 is C20H28O3.
What is the molecular weight of 糖松酸?
The molecular weight of 糖松酸 is 316.20 g/mol.
Where can I buy 糖松酸?
You can request a quote for 糖松酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 糖松酸?
Yes, KEHONG BIO provides custom synthesis services for 糖松酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.