Caradrin
TL;DR: Caradrin (CAS 466-06-8) 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-[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, Proscillaridin A, Caradrin, Proscillaridine, Proscilardyna
| 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 | 466-06-8 |
|---|---|
| SMILES | CC1C(C(C(C(O1)OC2CCC3(C4CCC5(C(CCC5(C4CCC3=C2)O)C6=COC(=O)C=C6)C)C)O)O)O |
| InChIKey | MYEJFUXQJGHEQK-UHFFFAOYSA-N |
Product Overview
Caradrin (CAS 466-06-8), with molecular formula C30H42O8 and molecular weight 530.29 g/mol. IUPAC: 5-[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 Caradrin
Property Insights of Caradrin
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Caradrin. The TPSA of 126.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Caradrin. Following Lipinski's Rule of Five, Caradrin 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 Caradrin?
The CAS number of Caradrin is 466-06-8.
What is the molecular formula of Caradrin?
The molecular formula of Caradrin is C30H42O8.
What is the molecular weight of Caradrin?
The molecular weight of Caradrin is 530.29 g/mol.
Where can I buy Caradrin?
You can request a quote for Caradrin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Caradrin?
Yes, KEHONG BIO provides custom synthesis services for Caradrin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.