Ilwensisaponin C
TL;DR: Ilwensisaponin C (CAS 141896-31-3) is a chemical compound with molecular formula C55H92O22 and molecular weight 1104.608 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[6-[2-[[4,8a-bis(hydroxymethyl)-14-methoxy-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-5-hydroxy-6-methyl-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-4-yl]oxy-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-6-methyloxane-3,4,5-triol
Also Known As: Mimengoside B, Ilwensisaponin C, 2-[6-[2-[[4,8a-bis(hydroxymethyl)-14-methoxy-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-5-hydroxy-6-methyl-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-4-yl]oxy-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-6-methyloxane-3,4,5-triol, beta-D-Galactopyranoside, (3beta,4alpha,11beta)-23,28-dihydroxy-11-methoxyolean-12-en-3-yl O-6-deoxy-alpha-L-mannopyranosyl-(1-4)- O-beta-D-glucopyranosyl-(1-3)-O-(beta-D-glucopyranosyl-(1-2))-6-deoxy-
Technical Specifications
| Molecular Formula | C55H92O22 |
| Molecular Weight | 1104.608 g/mol |
| XLogP | -0.2 |
| Topological Polar Surface Area (TPSA) | 346.0 Ų |
| Hydrogen Bond Donors | 13 |
| Hydrogen Bond Acceptors | 22 |
| Rotatable Bonds | 13 |
| Exact Mass | 1104.608 Da |
| Heavy Atoms | 77 |
| Complexity | 2070.0 |
| SMILES | CC1C(C(C(C(O1)OC2C(OC(C(C2O)O)OC3C(C(OC(C3OC4C(C(C(C(O4)CO)O)O)O)OC5CCC6(C(C5(C)CO)CCC7(C6C(C=C8C7(CCC9(C8CC(CC9)(C)C)CO)C)OC)C)C)C)O)CO)O)O)O |
| InChIKey | FOSCLSOVGLTOKV-UHFFFAOYSA-N |
Chemical Property Profile of Ilwensisaponin C
Property Insights of Ilwensisaponin C
The XLogP value of -0.2 indicates that Ilwensisaponin C is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 346.0 Ų indicates high polarity, suggesting Ilwensisaponin C may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Ilwensisaponin C has 13 hydrogen bond donor(s) and 22 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Ilwensisaponin C?
The CAS number of Ilwensisaponin C is 141896-31-3.
What is the molecular formula of Ilwensisaponin C?
The molecular formula of Ilwensisaponin C is C55H92O22.
What is the molecular weight of Ilwensisaponin C?
The molecular weight of Ilwensisaponin C is 1104.608 g/mol.
Where can I buy Ilwensisaponin C?
You can request a quote for Ilwensisaponin C directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ilwensisaponin C?
Yes, CoreyChem provides custom synthesis services for Ilwensisaponin C and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.