14-Hydroxy-17-(2-oxo-2,5-dihydro-3-furanyl)androstan-3-yl hexopyranoside
TL;DR: 14-Hydroxy-17-(2-oxo-2,5-dihydro-3-furanyl)androstan-3-yl hexopyranoside (CAS 36983-69-4) is a chemical compound with molecular formula C29H44O9 and molecular weight 536.30 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[14-hydroxy-10,13-dimethyl-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]-2H-furan-5-one
Also Known As: Actodigine, ACTODIGIN, Actodigino, Actodiginum, Actodigin [USAN:INN]
| Molecular Formula | C29H44O9 |
|---|---|
| Molecular Weight | 536.30 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 146.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 4 |
| Exact Mass | 536.2985 |
| Heavy Atoms | 38 |
| Complexity | 970.0 |
Chemical Identifiers
| CAS Number | 36983-69-4 |
|---|---|
| SMILES | CC12CCC(CC1CCC3C2CCC4(C3(CCC4C5=CCOC5=O)O)C)OC6C(C(C(C(O6)CO)O)O)O |
| InChIKey | ACLJAFRNPZVVIW-UHFFFAOYSA-N |
Product Overview
14-Hydroxy-17-(2-oxo-2,5-dihydro-3-furanyl)androstan-3-yl hexopyranoside (CAS 36983-69-4), with molecular formula C29H44O9 and molecular weight 536.30 g/mol. IUPAC: 4-[14-hydroxy-10,13-dimethyl-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]-2H-furan-5-one.
Chemical Property Profile of 14-Hydroxy-17-(2-oxo-2,5-dihydro-3-furanyl)androstan-3-yl hexopyranoside
Property Insights of 14-Hydroxy-17-(2-oxo-2,5-dihydro-3-furanyl)androstan-3-yl hexopyranoside
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 14-Hydroxy-17-(2-oxo-2,5-dihydro-3-furanyl)androstan-3-yl hexopyranoside. The TPSA of 146.0 Ų indicates high polarity, suggesting 14-Hydroxy-17-(2-oxo-2,5-dihydro-3-furanyl)androstan-3-yl hexopyranoside may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 14-Hydroxy-17-(2-oxo-2,5-dihydro-3-furanyl)androstan-3-yl hexopyranoside has 5 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 14-Hydroxy-17-(2-oxo-2,5-dihydro-3-furanyl)androstan-3-yl hexopyranoside?
The CAS number of 14-Hydroxy-17-(2-oxo-2,5-dihydro-3-furanyl)androstan-3-yl hexopyranoside is 36983-69-4.
What is the molecular formula of 14-Hydroxy-17-(2-oxo-2,5-dihydro-3-furanyl)androstan-3-yl hexopyranoside?
The molecular formula of 14-Hydroxy-17-(2-oxo-2,5-dihydro-3-furanyl)androstan-3-yl hexopyranoside is C29H44O9.
What is the molecular weight of 14-Hydroxy-17-(2-oxo-2,5-dihydro-3-furanyl)androstan-3-yl hexopyranoside?
The molecular weight of 14-Hydroxy-17-(2-oxo-2,5-dihydro-3-furanyl)androstan-3-yl hexopyranoside is 536.30 g/mol.
Where can I buy 14-Hydroxy-17-(2-oxo-2,5-dihydro-3-furanyl)androstan-3-yl hexopyranoside?
You can request a quote for 14-Hydroxy-17-(2-oxo-2,5-dihydro-3-furanyl)androstan-3-yl hexopyranoside directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 14-Hydroxy-17-(2-oxo-2,5-dihydro-3-furanyl)androstan-3-yl hexopyranoside?
Yes, KEHONG BIO provides custom synthesis services for 14-Hydroxy-17-(2-oxo-2,5-dihydro-3-furanyl)androstan-3-yl hexopyranoside and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.