Lobetyolin
TL;DR: Lobetyolin (CAS 129277-38-9) is a chemical compound with molecular formula C20H28O8 and molecular weight 396.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,7-dihydroxytetradeca-4,12-dien-8,10-diyn-6-yloxy)-6-(hydroxymethyl)oxane-3,4,5-triol
Also Known As: Lobetyolin, isolobetyol, 2-(1,7-dihydroxytetradeca-4,12-dien-8,10-diyn-6-yloxy)-6-(hydroxymethyl)oxane-3,4,5-triol, (2R,3R,4S,5S,6R)-2-(((4E,12E)-1,7-Dihydroxytetradeca-4,12-dien-8,10-diyn-6-yl)oxy)-6-(hydroxymethyl)tetrahydro-2H-pyran-3,4,5-triol, (2R,3R,4S,5S,6R)-2-[(4E,12E)-1,7-dihydroxytetradeca-4,12-dien-8,10-diyn-6-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
| Molecular Formula | C20H28O8 |
|---|---|
| Molecular Weight | 396.18 g/mol |
| LogP | -0.6 |
| Topological Polar Surface Area | 140.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 9 |
| Exact Mass | 396.1784 |
| Heavy Atoms | 28 |
| Complexity | 646.0 |
Chemical Identifiers
| CAS Number | 129277-38-9 |
|---|---|
| SMILES | CC=CC#CC#CC(C(C=CCCCO)OC1C(C(C(C(O1)CO)O)O)O)O |
| InChIKey | MMMUDYVKKPDZHS-UHFFFAOYSA-N |
Product Overview
Lobetyolin (CAS 129277-38-9), with molecular formula C20H28O8 and molecular weight 396.18 g/mol. IUPAC: 2-(1,7-dihydroxytetradeca-4,12-dien-8,10-diyn-6-yloxy)-6-(hydroxymethyl)oxane-3,4,5-triol.
Chemical Property Profile of Lobetyolin
Property Insights of Lobetyolin
The XLogP value of -0.6 indicates that Lobetyolin is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 140.0 Ų indicates high polarity, suggesting Lobetyolin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Lobetyolin has 6 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Lobetyolin?
The CAS number of Lobetyolin is 129277-38-9.
What is the molecular formula of Lobetyolin?
The molecular formula of Lobetyolin is C20H28O8.
What is the molecular weight of Lobetyolin?
The molecular weight of Lobetyolin is 396.18 g/mol.
Where can I buy Lobetyolin?
You can request a quote for Lobetyolin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Lobetyolin?
Yes, KEHONG BIO provides custom synthesis services for Lobetyolin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.