Neriifolin-diacetat
TL;DR: Neriifolin-diacetat (CAS 101418-21-7) is a chemical compound with molecular formula C34H50O10 and molecular weight 618.3404 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[(3R,6R)-6-[[(3S,5R,10S,13R,14S,17R)-14-acetyloxy-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]-5-hydroxy-4-methoxy-2-methyloxan-3-yl] acetate
Also Known As: Neriifolin-diacetat, Neriifolin-diacetat [German], 5-beta-Card-20(22)-enolide, 3-beta-((6-deoxy-3-O-methyl-beta-L-glucopyranosyl)oxy)-14-hydroxy-, 4',14-diacetate, 3-[(4-O-Acetyl-6-deoxy-3-O-methylhexopyranosyl)oxy]-14-(acetyloxy)card-20(22)-enolide, (8xi,9xi)-3beta-[(4-O-Acetyl-6-deoxy-3-O-methyl-beta-D-glycero-hexopyranosyl)oxy]-14-(acetyloxy)-5beta-card-20(22)-enolide
Technical Specifications
| Molecular Formula | C34H50O10 |
| Molecular Weight | 618.3404 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 127.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 8 |
| Exact Mass | 618.3404 Da |
| Heavy Atoms | 44 |
| Complexity | 1180.0 |
| SMILES | CC1[C@H](C(C([C@@H](O1)O[C@H]2CC[C@]3([C@@H](C2)CCC4C3CC[C@]5([C@@]4(CC[C@@H]5C6=CC(=O)OC6)OC(=O)C)C)C)O)OC)OC(=O)C |
| InChIKey | HCDHBGAWZMUQSN-DVPCZNHPSA-N |
Chemical Property Profile of Neriifolin-diacetat
Property Insights of Neriifolin-diacetat
The XLogP value of 3.2 indicates that Neriifolin-diacetat is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 127.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Neriifolin-diacetat. Following Lipinski's Rule of Five, Neriifolin-diacetat has 1 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Neriifolin-diacetat?
The CAS number of Neriifolin-diacetat is 101418-21-7.
What is the molecular formula of Neriifolin-diacetat?
The molecular formula of Neriifolin-diacetat is C34H50O10.
What is the molecular weight of Neriifolin-diacetat?
The molecular weight of Neriifolin-diacetat is 618.3404 g/mol.
Where can I buy Neriifolin-diacetat?
You can request a quote for Neriifolin-diacetat directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Neriifolin-diacetat?
Yes, CoreyChem provides custom synthesis services for Neriifolin-diacetat and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.