Determine the necessary mass, volume, or concentration for preparing a solution.
≥98%(HPLC) for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Room temperature Ships Normal Check lot-specific COA for exact specifications.
SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
| Pubchem Sid | 488180977 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/488180977 |
| Canonical Smiles | COC1=C(C2=C[N+]3=C(C=C2C=C1)C4=CC5=C(C=C4CC3)OCO5)OC.COC1=C(C2=C[N+]3=C(C=C2C=C1)C4=CC5=C(C=C4CC3)OCO5)OC.[O-]S(=O)(=O)[O-] |
| IUPAC Name | 16,17-dimethoxy-5,7-dioxa-13-azoniapentacyclo[11.8.0.02,10.04,8.015,20]henicosa-1(13),2,4(8),9,14,16,18,20-octaene;sulfate |
| InChIKey | OJVABJMSSDUECT-UHFFFAOYSA-L |
| INCHI | 1S/2C20H18NO4.H2O4S/c2*1-22-17-4-3-12-7-16-14-9-19-18(24-11-25-19)8-13(14)5-6-21(16)10-15(12)20(17)23-2;1-5(2,3)4/h2*3-4,7-10H,5-6,11H2,1-2H3;(H2,1,2,3,4)/q2*+1;/p-2 |
| Isomeric SMILES | COC1=C(C2=C[N+]3=C(C=C2C=C1)C4=CC5=C(C=C4CC3)OCO5)OC.COC1=C(C2=C[N+]3=C(C=C2C=C1)C4=CC5=C(C=C4CC3)OCO5)OC.[O-]S(=O)(=O)[O-] |
| RTECS | DR9867300 |
| Molecular Weight | 768.79 |
| Beilstein | 27500 |
| Reaxy-Rn | 3877732 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3877732&ln= |
Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS →Lot-specific quality data. Enter your lot number to retrieve the exact COA.
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| Lot Number | Certificate Type | Date | Item |
|---|---|---|---|
| Certificate of Analysis | May 11, 2026 | B137177 | |
| Certificate of Analysis | May 11, 2026 | B137177 | |
| Certificate of Analysis | May 11, 2026 | B137177 | |
| Certificate of Analysis | May 11, 2026 | B137177 | |
| Certificate of Analysis | Mar 05, 2025 | B137177 | |
| Certificate of Analysis | Aug 16, 2023 | B137177 | |
| Certificate of Analysis | Aug 16, 2023 | B137177 | |
| Certificate of Analysis | Jul 11, 2022 | B137177 |
| Solubility | Soluble in water |
|---|---|
| Molecular Weight | 768.800 g/mol |
| XLogP3 | |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 12 |
| Rotatable Bond Count | 4 |
| Exact Mass | 768.199 Da |
| Monoisotopic Mass | 768.199 Da |
| Topological Polar Surface Area | 170.000 Ų |
| Heavy Atom Count | 55 |
| Formal Charge | 0 |
| Complexity | 551.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 3 |
| 1. Qing Li, Yang Liu, Sili Liu, Shiqi Zhang, Xinke Yu, Zhili Wan, Yang Yuan, Paul Van der Meeren, Xiaoquan Yang. (2025) All-natural aggregation-induced emission-active glycyrrhizic acid hydrogels for drug-resistant bacteria-infected wound healing. CHEMICAL ENGINEERING JOURNAL, [PMID:] [10.1016/j.cej.2025.162677] |