Cassiaside C
TL;DR: Cassiaside C (CAS 119170-52-4) is a chemical compound with molecular formula C27H32O15 and molecular weight 596.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
10-hydroxy-7-methoxy-3-methyl-9-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxybenzo[g]isochromen-1-one
Also Known As: Cassiaside C, Toralactone 9-O-gentiobioside, toralactone 9-O-hexosyl-hexoside, HY-N7628, Toralactone 9-O-
| Molecular Formula | C27H32O15 |
|---|---|
| Molecular Weight | 596.17 g/mol |
| LogP | -2.02828 |
| Topological Polar Surface Area | 238.2 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 15 |
| Rotatable Bonds | 7 |
| Exact Mass | 596.17413 |
| Heavy Atoms | 42 |
| Complexity | 1488.1423 |
Chemical Identifiers
| CAS Number | 119170-52-4 |
|---|---|
| SMILES | CC1=CC2=CC3=CC(=CC(=C3C(=C2C(=O)O1)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O)O)O)O)OC |
Product Overview
Cassiaside C (CAS 119170-52-4), with molecular formula C27H32O15 and molecular weight 596.17 g/mol. IUPAC: 10-hydroxy-7-methoxy-3-methyl-9-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxybenzo[g]isochromen-1-one.
Chemical Property Profile of Cassiaside C
Property Insights of Cassiaside C
The XLogP value of -2.02828 indicates that Cassiaside C is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 238.2 Ų indicates high polarity, suggesting Cassiaside C may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Cassiaside C has 8 hydrogen bond donor(s) and 15 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Cassiaside C?
The CAS number of Cassiaside C is 119170-52-4.
What is the molecular formula of Cassiaside C?
The molecular formula of Cassiaside C is C27H32O15.
What is the molecular weight of Cassiaside C?
The molecular weight of Cassiaside C is 596.17 g/mol.
Where can I buy Cassiaside C?
You can request a quote for Cassiaside C directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cassiaside C?
Yes, KEHONG BIO provides custom synthesis services for Cassiaside C and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.