3-(Hexopyranosyloxy)-14-hydroxy-19-oxobufa-4,20,22-trienolide
TL;DR: 3-(Hexopyranosyloxy)-14-hydroxy-19-oxobufa-4,20,22-trienolide (CAS 73309-75-8) is a chemical compound with molecular formula C30H40O10 and molecular weight 560.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
14-hydroxy-13-methyl-17-(6-oxopyran-3-yl)-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,2,3,6,7,8,9,11,12,15,16,17-dodecahydrocyclopenta[a]phenanthrene-10-carbaldehyde
Also Known As: Altoside, Altosid (German), 3-(Hexopyranosyloxy)-14-hydroxy-19-oxobufa-4,20,22-trienolide, 3-beta-((beta-D-Glucopyranosyl)oxy)-14-hydroxy-19-oxo-bufa-4,20,22-trienolide, BUFA-4,20,22-TRIENOLIDE, 3-beta-((beta-D-GLUCOPYRANOSYL)OXY)-14-HYDROXY-19-OXO-
| Molecular Formula | C30H40O10 |
|---|---|
| Molecular Weight | 560.26 g/mol |
| LogP | 0.0 |
| Topological Polar Surface Area | 163.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 5 |
| Exact Mass | 560.26215 |
| Heavy Atoms | 40 |
| Complexity | 1130.0 |
Chemical Identifiers
| CAS Number | 73309-75-8 |
|---|---|
| SMILES | CC12CCC3C(C1(CCC2C4=COC(=O)C=C4)O)CCC5=CC(CCC35C=O)OC6C(C(C(C(O6)CO)O)O)O |
| InChIKey | AVMSZBMWLNNGEP-UHFFFAOYSA-N |
Product Overview
3-(Hexopyranosyloxy)-14-hydroxy-19-oxobufa-4,20,22-trienolide (CAS 73309-75-8), with molecular formula C30H40O10 and molecular weight 560.26 g/mol. IUPAC: 14-hydroxy-13-methyl-17-(6-oxopyran-3-yl)-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,2,3,6,7,8,9,11,12,15,16,17-dodecahydrocyclopenta[a]phenanthrene-10-carbaldehyde.
Chemical Property Profile of 3-(Hexopyranosyloxy)-14-hydroxy-19-oxobufa-4,20,22-trienolide
Property Insights of 3-(Hexopyranosyloxy)-14-hydroxy-19-oxobufa-4,20,22-trienolide
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(Hexopyranosyloxy)-14-hydroxy-19-oxobufa-4,20,22-trienolide. The TPSA of 163.0 Ų indicates high polarity, suggesting 3-(Hexopyranosyloxy)-14-hydroxy-19-oxobufa-4,20,22-trienolide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 3-(Hexopyranosyloxy)-14-hydroxy-19-oxobufa-4,20,22-trienolide has 5 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-(Hexopyranosyloxy)-14-hydroxy-19-oxobufa-4,20,22-trienolide?
The CAS number of 3-(Hexopyranosyloxy)-14-hydroxy-19-oxobufa-4,20,22-trienolide is 73309-75-8.
What is the molecular formula of 3-(Hexopyranosyloxy)-14-hydroxy-19-oxobufa-4,20,22-trienolide?
The molecular formula of 3-(Hexopyranosyloxy)-14-hydroxy-19-oxobufa-4,20,22-trienolide is C30H40O10.
What is the molecular weight of 3-(Hexopyranosyloxy)-14-hydroxy-19-oxobufa-4,20,22-trienolide?
The molecular weight of 3-(Hexopyranosyloxy)-14-hydroxy-19-oxobufa-4,20,22-trienolide is 560.26 g/mol.
Where can I buy 3-(Hexopyranosyloxy)-14-hydroxy-19-oxobufa-4,20,22-trienolide?
You can request a quote for 3-(Hexopyranosyloxy)-14-hydroxy-19-oxobufa-4,20,22-trienolide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(Hexopyranosyloxy)-14-hydroxy-19-oxobufa-4,20,22-trienolide?
Yes, KEHONG BIO provides custom synthesis services for 3-(Hexopyranosyloxy)-14-hydroxy-19-oxobufa-4,20,22-trienolide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.