Neooleuropein
TL;DR: Neooleuropein (CAS 108789-16-8) is a chemical compound with molecular formula C32H38O15 and molecular weight 662.22107 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(3,4-dihydroxyphenyl)ethyl (4S,5E,6S)-4-[2-[2-(3,4-dihydroxyphenyl)ethoxy]-2-oxoethyl]-5-ethylidene-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4H-pyran-3-carboxylate
Also Known As: Neooleuropein, Jasmultiside, J2.441.643G, 2-(3,4-dihydroxyphenyl)ethyl (4S,5E,6S)-4-[2-[2-(3,4-dihydroxyphenyl)ethoxy]-2-oxoethyl]-5-ethylidene-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4H-pyran-3-carboxylate, (2S,3E,4S)-5-[[2-(3,4-Dihydroxyphenyl)ethoxy]carbonyl]-3-ethylidene-2-(beta-D-glucopyranosyloxy)-3,4-dihydro-2H-pyran-4-acetic acid 2-(3,4-dihydroxyphenyl)ethyl ester
Technical Specifications
| Molecular Formula | C32H38O15 |
| Molecular Weight | 662.22107 g/mol |
| XLogP | 0.8 |
| Topological Polar Surface Area (TPSA) | 242.0 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 15 |
| Rotatable Bonds | 14 |
| Exact Mass | 662.22107 Da |
| Heavy Atoms | 47 |
| Complexity | 1100.0 |
| SMILES | C/C=C/1\[C@@H](C(=CO[C@H]1O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)C(=O)OCCC3=CC(=C(C=C3)O)O)CC(=O)OCCC4=CC(=C(C=C4)O)O |
| InChIKey | JIMGXIXILGGGKF-CNXMPEIMSA-N |
Chemical Property Profile of Neooleuropein
Property Insights of Neooleuropein
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Neooleuropein. The TPSA of 242.0 Ų indicates high polarity, suggesting Neooleuropein may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Neooleuropein has 8 hydrogen bond donor(s) and 15 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Neooleuropein?
The CAS number of Neooleuropein is 108789-16-8.
What is the molecular formula of Neooleuropein?
The molecular formula of Neooleuropein is C32H38O15.
What is the molecular weight of Neooleuropein?
The molecular weight of Neooleuropein is 662.22107 g/mol.
Where can I buy Neooleuropein?
You can request a quote for Neooleuropein directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Neooleuropein?
Yes, CoreyChem provides custom synthesis services for Neooleuropein and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.