Yuccoside C
TL;DR: Yuccoside C (CAS 55826-88-5) is a chemical compound with molecular formula C45H74O18 and molecular weight 902.49 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R,3R,4S,5R,6R)-2-[(2S,3R,4S,5S,6R)-2-[(2R,3S,4R,5R,6R)-4,5-dihydroxy-2-(hydroxymethyl)-6-[(1R,2S,4S,5'R,6R,7S,8R,9S,12S,13S,16S,18R)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,2'-oxane]-16-yl]oxyoxan-3-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
Also Known As: Yuccoside C, Tomatonin, beta-D-Glucopyranoside, (3-beta,5-beta,25S)-spirostan-3-yl O-alpha-D-galactopyranosyl-(1-2)-O-beta-D-glucopyranosyl-(1-4)-, beta-D-Glucopyranoside, (3beta,5beta,25S)-spirostan-3-yl O-alpha-D-galactopyranosyl-(1-2)-O-beta-D-glucopyranosyl-(1-4)-, (2R,3R,4S,5R,6R)-2-((2S,3R,4S,5S,6R)-2-((2R,3S,4R,5R,6R)-4,5-dihydroxy-2-(hydroxymethyl)-6-((1R,2S,4S,5'R,6R,7S,8R,9S,12S,13S,16S,18R)-5',7,9,13-tetramethylspiro(5-oxapentacyclo(10.8.0.02,9.04,8.013,18)icosane-6,2'-oxane)-16-yl)oxyoxan-3-yl)oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl)oxy-6-(hydroxymethyl)oxane-3,4,5-triol
| Molecular Formula | C45H74O18 |
|---|---|
| Molecular Weight | 902.49 g/mol |
| LogP | -0.7336 |
| Topological Polar Surface Area | 276.14 Ų |
| Hydrogen Bond Donors | 10 |
| Hydrogen Bond Acceptors | 18 |
| Rotatable Bonds | 9 |
| Exact Mass | 902.4875 |
| Heavy Atoms | 63 |
| Complexity | 1565.2241 |
Chemical Identifiers
| CAS Number | 55826-88-5 |
|---|---|
| SMILES | C[C@@H]1CC[C@@]2([C@H]([C@H]3[C@@H](O2)C[C@@H]4[C@@]3(CC[C@H]5[C@H]4CC[C@H]6[C@@]5(CC[C@@H](C6)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO)O[C@H]8[C@@H]([C@H]([C@@H]([C@H](O8)CO)O)O)O[C@@H]9[C@@H]([C@H]([C@H]([C@H](O9)CO)O)O)O)O)O)C)C)C)OC1 |
Product Overview
Yuccoside C (CAS 55826-88-5), with molecular formula C45H74O18 and molecular weight 902.49 g/mol. IUPAC: (2R,3R,4S,5R,6R)-2-[(2S,3R,4S,5S,6R)-2-[(2R,3S,4R,5R,6R)-4,5-dihydroxy-2-(hydroxymethyl)-6-[(1R,2S,4S,5'R,6R,7S,8R,9S,12S,13S,16S,18R)-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,2'-oxane]-16-yl]oxyoxan-3-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol.
Chemical Property Profile of Yuccoside C
Property Insights of Yuccoside C
The XLogP value of -0.7336 indicates that Yuccoside C is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 276.14 Ų indicates high polarity, suggesting Yuccoside C may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Yuccoside C has 10 hydrogen bond donor(s) and 18 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Yuccoside C?
The CAS number of Yuccoside C is 55826-88-5.
What is the molecular formula of Yuccoside C?
The molecular formula of Yuccoside C is C45H74O18.
What is the molecular weight of Yuccoside C?
The molecular weight of Yuccoside C is 902.49 g/mol.
Where can I buy Yuccoside C?
You can request a quote for Yuccoside C directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Yuccoside C?
Yes, KEHONG BIO provides custom synthesis services for Yuccoside C and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.