Sesamoside
TL;DR: Sesamoside (CAS 117480-53-2) is a chemical compound with molecular formula C17H24O12 and molecular weight 420.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (1S,2R,4S,5R,6R,10S)-5,6-dihydroxy-2-methyl-10-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,9-dioxatricyclo[4.4.0.02,4]dec-7-ene-7-carboxylate
Also Known As: Sesamoside, Sesamoside (Standard), HY-N0412R, HY-N0412, SESAMOSIDE (REFERENCE GRADE)
| Molecular Formula | C17H24O12 |
|---|---|
| Molecular Weight | 420.13 g/mol |
| LogP | -3.9046 |
| Topological Polar Surface Area | 187.9 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 4 |
| Exact Mass | 420.12677 |
| Heavy Atoms | 29 |
| Complexity | 710.5269 |
Chemical Identifiers
| CAS Number | 117480-53-2 |
|---|---|
| SMILES | C[C@@]12[C@H]3[C@@H](OC=C([C@]3([C@@H]([C@@H]1O2)O)O)C(=O)OC)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O |
Product Overview
Sesamoside (CAS 117480-53-2), with molecular formula C17H24O12 and molecular weight 420.13 g/mol. IUPAC: methyl (1S,2R,4S,5R,6R,10S)-5,6-dihydroxy-2-methyl-10-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,9-dioxatricyclo[4.4.0.02,4]dec-7-ene-7-carboxylate.
Chemical Property Profile of Sesamoside
Property Insights of Sesamoside
The XLogP value of -3.9046 indicates that Sesamoside is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 187.9 Ų indicates high polarity, suggesting Sesamoside may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Sesamoside has 6 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Sesamoside?
The CAS number of Sesamoside is 117480-53-2.
What is the molecular formula of Sesamoside?
The molecular formula of Sesamoside is C17H24O12.
What is the molecular weight of Sesamoside?
The molecular weight of Sesamoside is 420.13 g/mol.
Where can I buy Sesamoside?
You can request a quote for Sesamoside directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Sesamoside?
Yes, KEHONG BIO provides custom synthesis services for Sesamoside and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.