Tanghinoside
TL;DR: Tanghinoside (CAS 82145-54-8) is a chemical compound with molecular formula C44H66O20 and molecular weight 914.41 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[[18-hydroxy-10,14-dimethyl-15-(5-oxo-2H-furan-3-yl)-2-oxapentacyclo[9.7.0.01,3.05,10.014,18]octadecan-7-yl]oxy]-4-methoxy-6-methyl-5-[3,4,5-trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxyoxan-3-yl] acetate
Also Known As: TANGHINOSIDE, Card-20(22)-enolide, 7,8-epoxy-3-((O-beta-D-glucopyranosyl-(1->6)-O-beta-D-glucopyranosyl-(1->4)-2-O-acetyl-6-deoxy-3-O-methyl-alpha-L-glucopyranosyl)oxy)-14-hydroxy-, (3beta,5beta,7beta)-, 3-{[Hexopyranosyl-(1->6)hexopyranosyl-(1->4)-2-O-acetyl-6-deoxy-3-O-methylhexopyranosyl]oxy}-14-hydroxy-7,8-epoxycard-20(22)-enolide
| Molecular Formula | C44H66O20 |
|---|---|
| Molecular Weight | 914.41 g/mol |
| LogP | -2.0 |
| Topological Polar Surface Area | 292.0 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 20 |
| Rotatable Bonds | 12 |
| Exact Mass | 914.41473 |
| Heavy Atoms | 64 |
| Complexity | 1780.0 |
Chemical Identifiers
| CAS Number | 82145-54-8 |
|---|---|
| SMILES | CC1C(C(C(C(O1)OC2CCC3(C4CCC5(C(CCC5(C46C(O6)CC3C2)O)C7=CC(=O)OC7)C)C)OC(=O)C)OC)OC8C(C(C(C(O8)COC9C(C(C(C(O9)CO)O)O)O)O)O)O |
| InChIKey | MVAHEKHGGTVTDW-UHFFFAOYSA-N |
Product Overview
Tanghinoside (CAS 82145-54-8), with molecular formula C44H66O20 and molecular weight 914.41 g/mol. IUPAC: [2-[[18-hydroxy-10,14-dimethyl-15-(5-oxo-2H-furan-3-yl)-2-oxapentacyclo[9.7.0.01,3.05,10.014,18]octadecan-7-yl]oxy]-4-methoxy-6-methyl-5-[3,4,5-trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxyoxan-3-yl] acetate.
Chemical Property Profile of Tanghinoside
Property Insights of Tanghinoside
The XLogP value of -2.0 indicates that Tanghinoside is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 292.0 Ų indicates high polarity, suggesting Tanghinoside may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Tanghinoside has 8 hydrogen bond donor(s) and 20 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Tanghinoside?
The CAS number of Tanghinoside is 82145-54-8.
What is the molecular formula of Tanghinoside?
The molecular formula of Tanghinoside is C44H66O20.
What is the molecular weight of Tanghinoside?
The molecular weight of Tanghinoside is 914.41 g/mol.
Where can I buy Tanghinoside?
You can request a quote for Tanghinoside directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tanghinoside?
Yes, KEHONG BIO provides custom synthesis services for Tanghinoside and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.