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Basic Description
| Synonyms | Ligustilide | 4431-01-0 | Ligustilide A | (Z)-Ligustilide | 81944-09-4 | (Z)-3-Butylidene-4,5-dihydroisobenzofuran-1(3H)-one | cis-ligustilide | 1(3H)-Isobenzofuranone, 3-butylidene-4,5-dihydro-, (3Z)- | Z-ligustilide | 1(3H)-Isobenzofuranone, 3-butylidene-4,5-dihydro- | 3-b |
|---|---|
| Specifications & Purity | 10mM in DMSO |
| Biochemical and Physiological Mechanisms | Ligustilide can inhibit the proliferation of and cell cycle progression of vascular smooth muscle cells and inhibits vasoconstriction. It increases vasodilation, anti-thrombosis, and serotonergic activity and decreases platelet aggregation. |
| Storage Temp | Store at -80°C |
| Shipped In | Ice chest + Ice pads |
| Product Description | Ligustilide is a phthalide derivative that has been shown to have broad applications in the study and treatment of cardiovascular diseases and ischemic brain injury. |
Associated Targets(Human)
SLCO1B1 Tchem Solute carrier organic anion transporter family member 1B1 (2672 Activities)
SLCO1B3 Tchem Solute carrier organic anion transporter family member 1B3 (2517 Activities)
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Associated Targets(non-human)
Htr7 Serotonin 7 (5-HT7) receptor (19 Activities)
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Hdac6 Histone deacetylase 6 (222 Activities)
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MAL62 Alpha-glucosidase MAL62 (106 Activities)
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Drosophila melanogaster (359 Activities)
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Aedes aegypti (630 Activities)
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Mus musculus (284745 Activities)
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rep Replicase polyprotein 1ab (378 Activities)
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Trpa1 Transient receptor potential cation channel subfamily A member 1 (1003 Activities)
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Anopheles stephensi (118 Activities)
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Bemisia tabaci (599 Activities)
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Colletotrichum fragariae (147 Activities)
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Colletotrichum gloeosporioides (560 Activities)
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nAChRbeta2 Acetylcholine receptor subunit beta-like 2 (115 Activities)
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Colletotrichum acutatum (300 Activities)
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SARS-CoV-2 (38078 Activities)
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Names and Identifiers
| IUPAC Name | (3Z)-3-butylidene-4,5-dihydro-2-benzofuran-1-one |
|---|---|
| INCHI | InChI=1S/C12H14O2/c1-2-3-8-11-9-6-4-5-7-10(9)12(13)14-11/h5,7-8H,2-4,6H2,1H3/b11-8- |
| InChi Key | IQVQXVFMNOFTMU-FLIBITNWSA-N |
| Canonical SMILES | CCCC=C1C2=C(C=CCC2)C(=O)O1 |
| Isomeric SMILES | CCC/C=C\1/C2=C(C=CCC2)C(=O)O1 |
| Alternate CAS | 81944-09-4 |
| PubChem CID | 5319022 |
| Molecular Weight | 190.238 |
Certificates
Certificate of Analysis(COA)
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Chemical and Physical Properties
| Boil Point(°C) | 169℃/mmHg |
|---|---|
| Melt Point(°C) | 159℃ |
Safety and Hazards(GHS)
| Pictogram(s) | GHS06 |
|---|---|
| Signal | Danger |
| Hazard Statements | H301:Toxic if swallowed |
| Precautionary Statements | P321:Specific treatment (see ... on this label). P405:Store locked up. P501:Dispose of contents/container to ... P264:Wash hands [and …] thoroughly after handling. P270:Do not eat, drink or smoke when using this product. P330:Rinse mouth. P301+P316:IF SWALLOWED: Get emergency medical help immediately. |
Related Documents
Citations of This Product
| 1. Shasha He, Xuhua He, Shujuan Pan, Wenwen Jiang. (2023) Exploring the Mechanism of Chuanxiong Rhizoma against Thrombosis Based on Network Pharmacology, Molecular Docking and Experimental Verification. MOLECULES, 28 (18): (6702). [PMID:37764479] |
References
| 1. Shasha He, Xuhua He, Shujuan Pan, Wenwen Jiang. (2023) Exploring the Mechanism of Chuanxiong Rhizoma against Thrombosis Based on Network Pharmacology, Molecular Docking and Experimental Verification. MOLECULES, 28 (18): (6702). [PMID:37764479] |