proscillaridin
TL;DR: proscillaridin (CAS 49723-48-0) is a chemical compound with molecular formula C30H42O8 and molecular weight 530.29 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(3S,10R,13R,14S,17R)-14-hydroxy-10,13-dimethyl-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy-1,2,3,6,7,8,9,11,12,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]pyran-2-one
Also Known As: proscillaridin, Proscillaridine, Cardiovite, Proscillan, Proslladin
| Molecular Formula | C30H42O8 |
|---|---|
| Molecular Weight | 530.29 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 126.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 530.28796 |
| Heavy Atoms | 38 |
| Complexity | 1070.0 |
Chemical Identifiers
| CAS Number | 49723-48-0 |
|---|---|
| SMILES | CC1C(C(C(C(O1)O[C@H]2CC[C@@]3(C4CC[C@@]5([C@H](CC[C@@]5(C4CCC3=C2)O)C6=COC(=O)C=C6)C)C)O)O)O |
| InChIKey | MYEJFUXQJGHEQK-DYDCTSDLSA-N |
Product Overview
proscillaridin (CAS 49723-48-0), with molecular formula C30H42O8 and molecular weight 530.29 g/mol. IUPAC: 5-[(3S,10R,13R,14S,17R)-14-hydroxy-10,13-dimethyl-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy-1,2,3,6,7,8,9,11,12,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]pyran-2-one.
Chemical Property Profile of proscillaridin
Property Insights of proscillaridin
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for proscillaridin. The TPSA of 126.0 Ų falls within the moderate polarity range, balancing permeability and solubility for proscillaridin. Following Lipinski's Rule of Five, proscillaridin has 4 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of proscillaridin?
The CAS number of proscillaridin is 49723-48-0.
What is the molecular formula of proscillaridin?
The molecular formula of proscillaridin is C30H42O8.
What is the molecular weight of proscillaridin?
The molecular weight of proscillaridin is 530.29 g/mol.
Where can I buy proscillaridin?
You can request a quote for proscillaridin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for proscillaridin?
Yes, KEHONG BIO provides custom synthesis services for proscillaridin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.