heraclenol

7H-furo[3,2-g][1]benzopyran-7-one, 9-(2,3-dihydroxy-3-methylbutoxy)-

CAS: 31575-93-6 C16 H16 O6 MW: 304.29872000

Identification

Nameheraclenol
IUPAC9-(2,3-dihydroxy-3-methylbutoxy)furo[3,2-g]chromen-7-one
CAS Number31575-93-6
FDA UNII9WSY53477L
Molecular FormulaC16 H16 O6
Molecular Weight304.29872000
Nikkaji NumberJ493.550K
XlogP31.20 (est)

Regulatory

Physical Properties

Food Chemicals Codex Listed No
Boiling Point 544.00 to 545.00 °C. @ 760.00 mm Hg (est)
Flash Point 541.00 °F. TCC ( 283.00 °C. ) (est)
logP (o/w) 1.063 (est)
Soluble in water, 744.4 mg/L @ 25 °C (est)

No sensory data available

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 heraclenol usage levels up tonot for fragrance use.
Recommendation for heraclenol flavor usage levels up tonot for flavor use.

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Potential Uses

None Found

Natural Occurrence

citrus oils PMC lemon fruit oil parsley leaf oil @ 0.37% Data parsley seed

Synonyms

9-(2,3- dihydroxy-3-methylbutoxy)furo[3,2-g]chromen-7-one 7H- furo[3,2-g][1]benzopyran-7-one, 9-(2,3-dihydroxy-3-methylbutoxy)- PubMed: In vitro and in vivo antiproliferative effect of a combination of ultraviolet-A and alkoxy furocoumarins isolated from Umbelliferae medicinal plants, in melanoma cells. PubMed: [A new natural product from root of Angelica dahurica cv. Qibaizhi]. PubMed: Phytotoxic furanocoumarins from the shoots of Semenovia transiliensis. PubMed: Bioactivity-guided fractionation for the butyrylcholinesterase inhibitory activity of furanocoumarins from Angelica archangelica L. roots and fruits. PubMed: Vasorelaxation by extracts of Casimiroa spp. in rat resistance vessels and pharmacological study of cellular mechanisms. PubMed: [Chemical constituents of Incarvillea younghusbandii]. PubMed: Coumarins from Angelica lucida L.--antibacterial activities. PubMed: Screening of potential chemopreventive compounds from Poncirus trifoliata Raf. PubMed: Chemical constituents of Selinum cryptotaenium. PubMed: Candibirin A, a furanocoumarin dimer isolated from Heracleum candicans WALL. PubMed: Two new coumarin derivatives from the roots of Heracleum rapula. PubMed: A new dicoumarinyl ether and two rare furocoumarins from Ruta montana. PubMed: HPLC-NMR/HPLC-MS analysis of the bark extract of Stauranthus perforatus. PubMed: [Glucosides from Pleurospermum rivulorum]. PubMed: Triterpene and coumarins from Skimmia laureola. PubMed: A bioassay using the human hepatoblastoma cell line HepG2 for detecting phototoxicity of furocoumarins. PubMed: Three novel cyclospirobifuranocoumarins, cyclorivulobirins A-C, from Pleurospermum rivulorum. PubMed: Anti-inflammatory activity of coumarins from Decatropis bicolor on TPA ear mice model. PubMed: Antimycobacterial activity of chemically defined natural substances from the Caribbean flora in Guadeloupe. PubMed: [Studies on the chemical constituents of the herb huanghuaren (Sida acutá Burm. f.)].