sedanenolide

(-)-3-butyl-4,5-dihydro-1(3H)-isobenzofuranone

CAS: 62006-39-7 C12 H16 O2 MW: 192.25792000 herbal

Identification

Namesedanenolide
IUPAC3-butyl-4,5-dihydro-3H-2-benzofuran-1-one
CAS Number62006-39-7
FDA UNIISearch
Molecular FormulaC12 H16 O2
Molecular Weight192.25792000
Nikkaji NumberJ981.167B

Regulatory

Physical Properties

Food Chemicals Codex Listed No
Boiling Point 367.00 to 368.00 °C. @ 760.00 mm Hg
Vapor Pressure 0.000013 mmHg @ 25.00 °C. (est)
Flash Point 309.00 °F. TCC ( 153.89 °C. )
logP (o/w) 1.775 (est)
Soluble in alcohol
Insoluble in water

Organoleptic Properties

Odor Description at 1.00 % in propylene glycol.

Safety Information

Oral/Parenteral ToxicityNot determined
Dermal ToxicityNot determined
Inhalation ToxicityNot determined

GHS Classification

['GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)', 'GHS Label elements, including precautionary statements']

Safety in Use

Categorynatural substances and extractives
Recommendation for sedanenolide usage levels up tonot for fragrance use.
Recommendation for sedanenolide flavor usage levels up tonot for flavor use.

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Potential Uses

None Found

Natural Occurrence

carrot seed oil @ 0.13% Data celery root celery seed celery seed oil celery seed oil CO2 extract @ 22.39% Data celery seed oil india @ 9.89% Data dill root lovage root parsley leaf oil @ 2.29% Data parsley root parsley seed

Synonyms

(-)-3- butyl-4,5-dihydro-1(3H)-isobenzofuranone 3- butyl-4,5-dihydro-3H-2-benzofuran-1-one 3-N- butyl-4,5-dihydrophthalide 3-N- butyl-4,5-dihydrophthalide (S)-isomer senkyunolide senkyunolide A PubMed: Development of an analytical method coupling cell membrane chromatography with gas chromatography-mass spectrometry via microextraction by packed sorbent and its application in the screening of volatile active compounds in natural products. J-Stage: Asymmetric Synthesis and Sensory Evaluation of Sedanenolide PubMed: Evaluation of the influence of sulfur fumigation on the pharmacokinetics of four active ingredients in Si Wu Tang. PubMed: [Quantitative determination of 5 active ingredients in different harvest periods of Ligusticum chuanxiong by HPLC]. PubMed: Comparative analysis of main aromatic acids and phthalides in Angelicae Sinensis Radix, Chuanxiong Rhizoma, and Fo-Shou-San by a validated UHPLC-TQ-MS/MS. PubMed: Multi-component analysis in sun-dried and sulfur-fumigated Angelicae Sinensis Radix by single marker quantitation and chemometric discrimination. PubMed: Analysis of the Correlation between Commodity Grade and Quality of Angelica sinensis by Determination of Active Compounds Using Ultraperformance Liquid Chromatography Coupled with Chemometrics. PubMed: Optimization of high-pressure ultrasonic-assisted simultaneous extraction of six major constituents from Ligusticum chuanxiong rhizome using response surface methodology. PubMed: [Optimization of supercritical fluid extraction of bioactive components in Ligusticum chuanxiong by orthogonal array design]. PubMed: Chemistry, technology, and nutraceutical functions of celery (Apium graveolens L.): an overview. PubMed: [Study on the constituents of essential oil of Shunaoxin dropping pills by GC-MS]. PubMed: [Chemical change of chuanxiong raw materials during storage]. PubMed: Chemical changes of Angelicae Sinensis Radix and Chuanxiong Rhizoma by wine treatment: chemical profiling and marker selection by gas chromatography coupled with triple quadrupole mass spectrometry. PubMed: Utilization of gene expression signature for quality control of traditional Chinese medicine formula Si-Wu-Tang. PubMed: Online isolation and purification of four phthalide compounds from Chuanxiong rhizoma using high-speed counter-current chromatography coupled with semi-preparative liquid chromatography. PubMed: [Analysis of chemical constituents of chuanxiong rhizoma absorbed into rat brain tissues by UPLC-Q-TOF-MS]. PubMed: Chemical and biological assessment of angelica roots from different cultivated regions in a chinese herbal decoction danggui buxue tang. PubMed: Isolation of the volatile fraction from Apium graveolens L. (Apiaceae) by supercritical carbon dioxide extraction and hydrodistillation: chemical composition and antifungal activity. PubMed: Chemometric classification of morphologically similar Umbelliferae medicinal herbs by DART-TOF-MS fingerprint. PubMed: Identification of the absorbed components and metabolites in rat plasma after oral administration of Rhizoma Chuanxiong decoction by HPLC-ESI-MS/MS. PubMed: [Studies on the chemical constituents of Ligusticum sinense]. PubMed: Asymmetric synthesis and sensory evaluation of sedanenolide. PubMed: A bio-activity guided in vitro pharmacokinetic method to improve the quality control of Chinese medicines, application to Si Wu Tang. PubMed: Isolation and identification of anti-inflammatory constituents from Ligusticum chuanxiong and their underlying mechanisms of action on microglia. PubMed: [Analysis of volatile oils of Ligusticum chuanxiong Hort. from different geographical origins by comprehensive two-dimensional gas chromatography/time-of-flight mass spectrometry]. PubMed: Identification and comparative quantification of bio-active phthalides in essential oils from si-wu-tang, fo-shou-san, radix angelica and rhizoma chuanxiong. PubMed: Simultaneous determination of phenolic acids and phthalide compounds by liquid chromatography for quality assessment of Rhizoma cnidii. PubMed: Simultaneous quantification of active components in the herbs and products of Si-Wu-Tang by high performance liquid chromatography-mass spectrometry. PubMed: Identification and determination of the major constituents in Traditional Chinese Medicinal formula Danggui-Shaoyao-San by HPLC-DAD-ESI-MS/MS. PubMed: GC-MS fingerprints for discrimination of Ligusticum chuanxiong from Angelica. PubMed: Study of the anti-proliferative effects and synergy of phthalides from Angelica sinensis on colon cancer cells. PubMed: Flavor enhancement of chicken broth from boiled celery constituents. PubMed: Characterization of interaction property of multicomponents in Chinese Herb with protein by microdialysis combined with HPLC. PubMed: Comparative analysis of Ligusticum chuanxiong and related umbelliferous medicinal plants by high performance liquid chromatography-electrospray ionization mass spectrometry. PubMed: Low oral bioavailability and pharmacokinetics of senkyunolide a, a major bioactive component in Rhizoma Chuanxiong, in the rat. PubMed: Relaxation effects of ligustilide and senkyunolide A, two main constituents of Ligusticum chuanxiong, in rat isolated aorta. PubMed: Post-harvest alteration of the main chemical ingredients in Ligusticum chuanxiong Hort. (Rhizoma Chuanxiong). PubMed: Screening and analysis of the multiple absorbed bioactive components and metabolites of Dangguibuxue decoction by the metabolic fingerprinting technique and liquid chromatography/diode-array detection mass spectrometry. PubMed: Potent odorants characterize the aroma quality of leaves and stalks in raw and boiled celery. PubMed: Time-course accumulation of main bioactive components in the rhizome of Ligusticum chuanxiong. PubMed: [Determination of lactone components in chuanxiong by reversed-phase high performance liquid chromatography]. PubMed: Identification and comparative determination of senkyunolide A in traditional Chinese medicinal plants Ligusticum chuanxiong and Angelica sinensis by HPLC coupled with DAD and ESI-MS. PubMed: Phthalide Lactones from Ligusticum chuanxiong inhibit lipopolysaccharide-induced TNF-alpha production and TNF-alpha-mediated NF-kappaB Activation. PubMed: Development of high-performance liquid chromatographic fingerprints for distinguishing Chinese Angelica from related umbelliferae herbs. PubMed: HPLC-coupled spectroscopic techniques (UV, MS, NMR) for the structure elucidation of phthalides in Ligusticum chuanxiong. PubMed: [Study on fingerprint of rhizoma chuanxiong by HPLC-DAD-MS]. PubMed: Phytochemical analysis of anti-atherogenic constituents of Xue-Fu-Zhu-Yu-Tang using HPLC-DAD-ESI-MS. PubMed: Simultaneous analysis of seventeen chemical ingredients of Ligusticum chuanxiong by on-line high performance liquid chromatography-diode array detector-mass spectrometry. PubMed: Separation and identification of the phthalic anhydride derivatives of Liqusticum Chuanxiong Hort by GC-MS, TLC, HPLC-DAD, and HPLC-MS. PubMed: Phthalide-based host-plant resistance toSpodoptera exigua andTrichoplusia ni inApium graveolens. PubMed: Chemical structure-activity of cnidium rhizome-derived phthalides for the competence inhibition of proliferation in primary cultures of mouse aorta smooth muscle cells. PubMed: Antiproliferative effects of the traditional Chinese medicine shimotsu-to, its component cnidium rhizome and derived compounds on primary cultures of mouse aorta smooth muscle cells.