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Rupestonic acid

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Category Influenza Virus
CAS 83161-56-2
Description Rupestonic acid is a sesquiterpenoid found in Pechuel-loeschea leubnitziae and Artemisia rupestris. It can inhibit the influenza virus.
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Product Information

Synonyms Rupestonic acid;Pechueloic Acid;83161-56-2;2-[(5R,8S,8aS)-3,8-dimethyl-2-oxo-4,5,6,7,8,8a-hexahydro-1H-azulen-5-yl]prop-2-enoic acid;5-Azuleneacetic acid,1,2,4,5,6,7,8,8a-octahydro-3,8-dimethyl-a-methylene-2-oxo-,[5R-(5a,8a,8ab)]-;115473-63-7;MEGxp0_001667;CHEMBL1956398;SCHEMBL13250880;ACon1_001383;CHEBI:183941;HY-N3016;AKOS040740904;NCGC00180565-01;NCGC00180565-02;DA-57577;MS-23517;CS-0022973;E88596;BRD-K13964656-001-01-2;2-((5r,8s,8as)-3,8-dimethyl-2-oxo-1,2,4,5,6,7,8,8a-octahydroazulen-5-yl) acrylic acid;
IUPAC Name 2-[(5R,8S,8aS)-3,8-dimethyl-2-oxo-4,5,6,7,8,8a-hexahydro-1H-azulen-5-yl]prop-2-enoic acid
Molecular Weight 444.5
Molecular Formula C24H28O8
Canonical SMILES C[C@@H]1CC2=CC(=C(C(=C2C3=C(C4=C(C=C3[C@@H]([C@@H]1C)OC(=O)C)OCO4)OC)O)OC)OC
InChI InChI=1S/C15H20O3/c1-8-4-5-11(9(2)15(17)18)6-13-10(3)14(16)7-12(8)13/h8,11-12H,2,4-7H2,1,3H3,(H,17,18)/t8-,11+,12-/m0/s1
InChIKey ZFHSKBJBODQVBX-AXTRIDKLSA-N
Boiling Point 438.0±24.0°C at 760 mmHg
Melting Point 128-130°C
Purity ≥95%
Density 1.12±0.1 g/cm3
Solubility Soluble in Acetone, Chloroform, Dichloromethane, DMSO, Ethyl Acetate
Appearance Solid
Storage 4°C, protect from light
*In solvent : -80°C, 6 months; -20°C, 1 month (protect from light)

Description of First Aid Measures

Eye contact

Remove any contact lenses, locate eye-wash station, and flush eyes immediately with large amounts of water. Separate eyelids with fingers to ensure adequate flushing. Promptly call a physician.

Skin contact

Rinse skin thoroughly with large amounts of water. Remove contaminated clothing and shoes and call a physician.

Inhalation

Immediately relocate self or casualty to fresh air. If breathing is difficult, give cardiopulmonary resuscitation (CPR). Avoid mouth-to-mouth resuscitation.

Ingestion

Wash out mouth with water; Do NOT induce vomiting; call a physician.

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