≥98% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Store at -20°C Ships Ice chest + Ice pads 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.
Information
Levistilide A Levistilide A (Diligustilide), a natural compound isolated from the traditional Chinese herb Ligusticum chuanxiong Hort , is a potential P-gp modulator and used for treating cancer.
| ALogP | 4.97 |
|---|---|
| hba_count | 4 |
| 回転可能な結合 | 4 |
| パブケム・シド | 488202153 |
|---|---|
| パブケム・シド・ウル | https://pubchem.ncbi.nlm.nih.gov/substance/488202153 |
| カノニカル・スマイル | CCCC=C1C2=C(C3C(CC2)C4CCC35C(=C4)C(=O)OC5=CCCC)C(=O)O1 |
| IUPAC Name | (1S,2S,6Z,10S,11S,16Z)-6,16-di(butylidene)-5,15-dioxapentacyclo[9.5.2.01,13.02,10.03,7]octadeca-3(7),12-diene-4,14-dione |
| InChIKey | UBBRXVRQZJSDAK-ZJHGLIIDSA-N |
| INCHI | 1S/C24H28O4/c1-3-5-7-18-16-10-9-15-14-11-12-24(21(15)20(16)23(26)27-18)17(13-14)22(25)28-19(24)8-6-4-2/h7-8,13-15,21H,3-6,9-12H2,1-2H3/b18-7-,19-8-/t14-,15+,21-,24+/m1/s1 |
| 異性体SMILES | CCC/C=C\1/C2=C([C@H]3[C@@H](CC2)[C@@H]4CC[C@@]3\5C(=C4)C(=O)O/C5=C\CCC)C(=O)O1 |
| 分子量 | 380.48 |
| Reaxy-Rn | 19588545 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=19588545&ln= |
Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS →Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA →Full quality attributes and acceptance criteria for this grade.
View spec sheet →Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Organoheterocyclic compounds |
| 分類 | Dihydrofurans |
| Subclass | Furanones |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Butenolides |
| Alternative Parents | Dicarboxylic acids and derivatives Tetrahydrofurans Enol esters Enoate esters Lactones Oxacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds |
| Molecular Framework | Aliphatic heteropolycyclic compounds |
| Substituents | 2-furanone - Dicarboxylic acid or derivatives - Enol ester - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Tetrahydrofuran - Carboxylic acid ester - Lactone - Carboxylic acid derivative - Oxacycle - Hydrocarbon derivative - Organic oxide - Carbonyl group - Organic oxygen compound - Organooxygen compound - Aliphatic heteropolycyclic compound |
| 説明 | This compound belongs to the class of organic compounds known as butenolides. These are dihydrofurans with a carbonyl group at the C2 carbon atom. |
| External Descriptors | butenolide |
Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | 日付 | 商品 |
|---|---|---|---|
 E2316571 | Certificate of Analysis | Feb 04, 2026 | L414363 |
| E2316575 | Certificate of Analysis | Feb 04, 2026 | L414363 |
| E2316576 | Certificate of Analysis | Feb 04, 2026 | L414363 |
| E2316577 | Certificate of Analysis | Feb 04, 2026 | L414363 |
| E2316581 | Certificate of Analysis | Feb 04, 2026 | L414363 |
| E2316582 | Certificate of Analysis | Feb 04, 2026 | L414363 |
| E2316583 | Certificate of Analysis | Feb 04, 2026 | L414363 |
| E2316601 | Certificate of Analysis | Feb 04, 2026 | L414363 |
| E2316606 | Certificate of Analysis | Feb 04, 2026 | L414363 |
| E2316649 | Certificate of Analysis | Feb 04, 2026 | L414363 |
| I2228133 | Certificate of Analysis | Jul 10, 2025 | L414363 |
| I2228134 | Certificate of Analysis | Jul 10, 2025 | L414363 |
| I2228135 | Certificate of Analysis | Jul 10, 2025 | L414363 |
| I2228137 | Certificate of Analysis | Jul 10, 2025 | L414363 |
| I2228138 | Certificate of Analysis | Sep 13, 2022 | L414363 |
| 溶解度 | Solubility (25°C) In vitro DMSO: 76 mg/mL (199.74 mM); |
|---|---|
| DMSO（mg / mL） 最大溶解度 | 76 |
| DMSO（mM） 最大溶解度 | 199.747687132044 |
| 水（mg / mL） 最大溶解度 | -1 |
| 分子量 | 380.500 g/mol |
| XLogP3 | 4.900 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 4 |
| Exact Mass | 380.199 Da |
| Monoisotopic Mass | 380.199 Da |
| Topological Polar Surface Area | 52.600 Ų |
| Heavy Atom Count | 28 |
| Formal Charge | 0 |
| Complexity | 871.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 4 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 2 |
| Covalently-Bonded Unit Count | 1 |
