Saponin
TL;DR: Saponin (CAS 23643-76-7) is a chemical compound with molecular formula C58H94O27 and molecular weight 1222.60 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R,4S,5R,10S,13R,14R,18S,20R)-10-[(2S,3R,4S,5S)-3-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-4-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-5-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-2-hydroxy-4,5,9,9,13,20-hexamethyl-24-oxahexacyclo[15.5.2.01,18.04,17.05,14.08,13]tetracosane-20-carbaldehyde
Also Known As: SAPONIN, Cyclamin, Cyclamine, Cyclamin (saponin), Steroid Saponins
| Molecular Formula | C58H94O27 |
|---|---|
| Molecular Weight | 1222.60 g/mol |
| LogP | -2.7 |
| Topological Polar Surface Area | 422.0 Ų |
| Hydrogen Bond Donors | 15 |
| Hydrogen Bond Acceptors | 27 |
| Rotatable Bonds | 14 |
| Exact Mass | 1222.5983 |
| Heavy Atoms | 85 |
| Complexity | 2340.0 |
Chemical Identifiers
| CAS Number | 23643-76-7 |
|---|---|
| SMILES | C[C@]1(CCC23COC4([C@H]2C1)CC[C@@H]5[C@]6(CC[C@@H](C(C6CC[C@]5([C@@]4(C[C@H]3O)C)C)(C)C)O[C@H]7[C@@H]([C@H]([C@H](CO7)O[C@H]8[C@@H]([C@H]([C@@H](CO8)O)O)O)O[C@@H]9[C@@H]([C@H]([C@@H]([C@H](O9)CO)O)O)O)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O[C@@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)C)C=O |
| InChIKey | MAEBCGDGGATMSC-OSHGGGOQSA-N |
Product Overview
Saponin (CAS 23643-76-7), with molecular formula C58H94O27 and molecular weight 1222.60 g/mol. IUPAC: (2R,4S,5R,10S,13R,14R,18S,20R)-10-[(2S,3R,4S,5S)-3-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-4-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-5-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-2-hydroxy-4,5,9,9,13,20-hexamethyl-24-oxahexacyclo[15.5.2.01,18.04,17.05,14.08,13]tetracosane-20-carbaldehyde.
Chemical Property Profile of Saponin
Property Insights of Saponin
The XLogP value of -2.7 indicates that Saponin is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 422.0 Ų indicates high polarity, suggesting Saponin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Saponin has 15 hydrogen bond donor(s) and 27 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Saponin?
The CAS number of Saponin is 23643-76-7.
What is the molecular formula of Saponin?
The molecular formula of Saponin is C58H94O27.
What is the molecular weight of Saponin?
The molecular weight of Saponin is 1222.60 g/mol.
Where can I buy Saponin?
You can request a quote for Saponin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Saponin?
Yes, KEHONG BIO provides custom synthesis services for Saponin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.