海杧果苷
TL;DR: 海杧果苷 (CAS 25633-33-4) is a chemical compound with molecular formula C32H48O9 and molecular weight 576.33 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
海杧果苷
[5-hydroxy-2-[[14-hydroxy-10,13-dimethyl-17-(5-oxo-2H-furan-3-yl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl]oxy]-4-methoxy-6-methyloxan-3-yl] acetate
Also Known As: Cerberin, 2'-acetylneriifolin, [5-hydroxy-2-[[14-hydroxy-10,13-dimethyl-17-(5-oxo-2H-furan-3-yl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl]oxy]-4-methoxy-6-methyloxan-3-yl] acetate
| Molecular Formula | C32H48O9 |
|---|---|
| Molecular Weight | 576.33 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 121.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 6 |
| Exact Mass | 576.32983 |
| Heavy Atoms | 41 |
| Complexity | 1080.0 |
Chemical Identifiers
| CAS Number | 25633-33-4 |
|---|---|
| SMILES | CC1C(C(C(C(O1)OC2CCC3(C(C2)CCC4C3CCC5(C4(CCC5C6=CC(=O)OC6)O)C)C)OC(=O)C)OC)O |
| InChIKey | UYQMTWMXBKEHJQ-UHFFFAOYSA-N |
Product Overview
海杧果苷 (CAS 25633-33-4), with molecular formula C32H48O9 and molecular weight 576.33 g/mol. IUPAC: [5-hydroxy-2-[[14-hydroxy-10,13-dimethyl-17-(5-oxo-2H-furan-3-yl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl]oxy]-4-methoxy-6-methyloxan-3-yl] acetate.
Chemical Property Profile of 海杧果苷
Property Insights of 海杧果苷
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 海杧果苷. The TPSA of 121.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 海杧果苷. Following Lipinski's Rule of Five, 海杧果苷 has 2 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 海杧果苷?
The CAS number of 海杧果苷 is 25633-33-4.
What is the molecular formula of 海杧果苷?
The molecular formula of 海杧果苷 is C32H48O9.
What is the molecular weight of 海杧果苷?
The molecular weight of 海杧果苷 is 576.33 g/mol.
Where can I buy 海杧果苷?
You can request a quote for 海杧果苷 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 海杧果苷?
Yes, KEHONG BIO provides custom synthesis services for 海杧果苷 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.