Cistanoside C
TL;DR: Cistanoside C (CAS 94492-22-5) is a chemical compound with molecular formula C31H38O15 and molecular weight 650.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2S,3S,4R,5R,6R)-2-acetyl-5-hydroxy-6-[2-(4-hydroxy-3-methoxyphenyl)ethoxy]-4-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl] (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate
Also Known As: Cistanoside C, [(2S,3S,4R,5R,6R)-2-acetyl-5-hydroxy-6-[2-(4-hydroxy-3-methoxyphenyl)ethoxy]-4-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl] (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate, Glucopyranoside, 2-(3-methoxy-4-hydroxyphenyl)ethyl 3-O-(6-deoxy-alpha-L- mannopyranosyl)-, 4-(3-(3,4-dihydroxyphenyl)-2-propenoate), (E)-beta-D-, [(2S,3S,4R,5R,6R)-2-acetyl-5-hydroxy-6-[2-(4-hydroxy-3-methoxy-phenyl)ethoxy]-4-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl]oxy-tetrahydropyran-3-yl] (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate
| Molecular Formula | C31H38O15 |
|---|---|
| Molecular Weight | 650.22 g/mol |
| LogP | -0.1162 |
| Topological Polar Surface Area | 231.13 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 15 |
| Rotatable Bonds | 11 |
| Exact Mass | 650.22107 |
| Heavy Atoms | 46 |
| Complexity | 1395.9889 |
Chemical Identifiers
| CAS Number | 94492-22-5 |
|---|---|
| SMILES | C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O[C@@H]2[C@H]([C@@H](O[C@@H]([C@H]2OC(=O)/C=C/C3=CC(=C(C=C3)O)O)C(=O)C)OCCC4=CC(=C(C=C4)O)OC)O)O)O)O |
Product Overview
Cistanoside C (CAS 94492-22-5), with molecular formula C31H38O15 and molecular weight 650.22 g/mol. IUPAC: [(2S,3S,4R,5R,6R)-2-acetyl-5-hydroxy-6-[2-(4-hydroxy-3-methoxyphenyl)ethoxy]-4-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl] (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate.
Chemical Property Profile of Cistanoside C
Property Insights of Cistanoside C
The XLogP value of -0.1162 indicates that Cistanoside C is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 231.13 Ų indicates high polarity, suggesting Cistanoside C may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Cistanoside C has 7 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 Cistanoside C?
The CAS number of Cistanoside C is 94492-22-5.
What is the molecular formula of Cistanoside C?
The molecular formula of Cistanoside C is C31H38O15.
What is the molecular weight of Cistanoside C?
The molecular weight of Cistanoside C is 650.22 g/mol.
Where can I buy Cistanoside C?
You can request a quote for Cistanoside C directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cistanoside C?
Yes, KEHONG BIO provides custom synthesis services for Cistanoside C and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.