13(S)-羟基十八碳三烯酸
TL;DR: 13(S)-羟基十八碳三烯酸 (CAS 74784-20-6) is a chemical compound with molecular formula C18H30O3 and molecular weight 294.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
13(S)-羟基十八碳三烯酸
13-hydroxyoctadeca-6,9,11-trienoic acid
Also Known As: 13(S)-HOTrE(I(3)), 13-hydroxyoctadeca-6,9,11-trienoic acid, 13(S)-Hotre(, inverted exclamation marke), 13(S)-Hotre(
| Molecular Formula | C18H30O3 |
|---|---|
| Molecular Weight | 294.22 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 57.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 13 |
| Exact Mass | 294.21948 |
| Heavy Atoms | 21 |
| Complexity | 329.0 |
Chemical Identifiers
| CAS Number | 74784-20-6 |
|---|---|
| SMILES | CCCCCC(C=CC=CCC=CCCCCC(=O)O)O |
| InChIKey | HNBLUNXZQNJFRB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
13(S)-羟基十八碳三烯酸 (CAS 74784-20-6), with molecular formula C18H30O3 and molecular weight 294.22 g/mol. IUPAC: 13-hydroxyoctadeca-6,9,11-trienoic acid.
Chemical Property Profile of 13(S)-羟基十八碳三烯酸
Property Insights of 13(S)-羟基十八碳三烯酸
The XLogP value of 4.7 indicates that 13(S)-羟基十八碳三烯酸 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.5 Ų, 13(S)-羟基十八碳三烯酸 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 13(S)-羟基十八碳三烯酸 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 13(S)-羟基十八碳三烯酸?
The CAS number of 13(S)-羟基十八碳三烯酸 is 74784-20-6.
What is the molecular formula of 13(S)-羟基十八碳三烯酸?
The molecular formula of 13(S)-羟基十八碳三烯酸 is C18H30O3.
What is the molecular weight of 13(S)-羟基十八碳三烯酸?
The molecular weight of 13(S)-羟基十八碳三烯酸 is 294.22 g/mol.
Where can I buy 13(S)-羟基十八碳三烯酸?
You can request a quote for 13(S)-羟基十八碳三烯酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 13(S)-羟基十八碳三烯酸?
Yes, KEHONG BIO provides custom synthesis services for 13(S)-羟基十八碳三烯酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.