Erichroside
TL;DR: Erichroside (CAS 630-65-9) is a chemical compound with molecular formula C34H50O13 and molecular weight 666.33 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3S,5S,8R,9S,10S,13R,14S,17R)-5,14-dihydroxy-3-[(2R,4S,5S,6R)-4-hydroxy-6-methyl-5-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-13-methyl-17-(5-oxo-2H-furan-3-yl)-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-10-carbaldehyde
Also Known As: Erychroside, Erichroside, Erychroside (7CI), KST-1A7051, Strophanthidin, 3-(4-O-beta-D-xylosyl-beta-D-digitoxoside)
| Molecular Formula | C34H50O13 |
|---|---|
| Molecular Weight | 666.33 g/mol |
| LogP | -1.2 |
| Topological Polar Surface Area | 202.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 6 |
| Exact Mass | 666.32513 |
| Heavy Atoms | 47 |
| Complexity | 1260.0 |
Chemical Identifiers
| CAS Number | 630-65-9 |
|---|---|
| SMILES | C[C@@H]1[C@H]([C@H](C[C@@H](O1)O[C@H]2CC[C@@]3([C@H]4CC[C@@]5([C@H](CC[C@@]5([C@@H]4CC[C@@]3(C2)O)O)C6=CC(=O)OC6)C)C=O)O)O[C@H]7[C@@H]([C@H]([C@@H](CO7)O)O)O |
| InChIKey | GPMRZMZJGUPWPZ-BRBRUXTHSA-N |
Product Overview
Erichroside (CAS 630-65-9), with molecular formula C34H50O13 and molecular weight 666.33 g/mol. IUPAC: (3S,5S,8R,9S,10S,13R,14S,17R)-5,14-dihydroxy-3-[(2R,4S,5S,6R)-4-hydroxy-6-methyl-5-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-13-methyl-17-(5-oxo-2H-furan-3-yl)-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-10-carbaldehyde.
Chemical Property Profile of Erichroside
Property Insights of Erichroside
The XLogP value of -1.2 indicates that Erichroside is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 202.0 Ų indicates high polarity, suggesting Erichroside may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Erichroside has 6 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Erichroside?
The CAS number of Erichroside is 630-65-9.
What is the molecular formula of Erichroside?
The molecular formula of Erichroside is C34H50O13.
What is the molecular weight of Erichroside?
The molecular weight of Erichroside is 666.33 g/mol.
Where can I buy Erichroside?
You can request a quote for Erichroside directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Erichroside?
Yes, KEHONG BIO provides custom synthesis services for Erichroside and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.