botryodiplodin

2-hydroxy-3-methyl-4-acetyltetrahydrofuran

CAS: 27098-03-9 C7 H12 O3 MW: 144.17024000

Identification

Namebotryodiplodin
IUPAC1-(5-hydroxy-4-methyloxolan-3-yl)ethanone
CAS Number27098-03-9
FDA UNII5G35Q22R8M
Molecular FormulaC7 H12 O3
Molecular Weight144.17024000
Nikkaji NumberJ16.997H
Beilstein2935786

Regulatory

Physical Properties

Assay 95.00 to 100.00
Food Chemicals Codex Listed No
Boiling Point 249.36 °C. @ 760.00 mm Hg (est)
Vapor Pressure 0.004000 mmHg @ 25.00 °C. (est)
Flash Point 214.00 °F. TCC ( 101.40 °C. ) (est)
logP (o/w) 0.571 (est)
Soluble in water, 1e+006 mg/L @ 25 °C (est)

No sensory data available

Safety Information

Oral/Parenteral Toxicityunreported-mouse LD50 40 mg/kg
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 botryodiplodin usage levels up tonot for fragrance use.
Recommendation for botryodiplodin flavor usage levels up tonot for flavor use.

No supplier data available

Potential Uses

None Found

Natural Occurrence

botryodiplodia theobromae

Synonyms

antibiotic PSX 1 botrydiplodin botryodipolodin botyrodiplodin cytostipin ethanone, 1-(tetrahydro-5-hydroxy-4-methyl-3-furanyl)- (9CI) 2- hydroxy-3-methyl-4-acetyl tetrahydrofuran 2- hydroxy-3-methyl-4-acetyltetrahydrofuran 2- hydroxy-3-methyl-4-acetyltetrahydrofurane 1-(5- hydroxy-4-methyloxolan-3-yl)ethanone ketone, methyl tetrahydro-5-hydroxy-4-methyl-3-furyl methyltetrahydro-5-hydroxy-4-methyl-3-furyl-ketone 1-( tetrahydro-5-hydroxy-4-methyl-3-furanyl)ethanone PubMed: Lasiojasmonates A-C, three jasmonic acid esters produced by Lasiodiplodia sp., a grapevine pathogen. PubMed: Isolation and structural elucidation of eight new related analogues of the mycotoxin (-)-botryodiplodin from Penicillium coalescens. PubMed: Soybean charcoal rot disease fungus Macrophomina phaseolina in Mississippi produces the phytotoxin (-)-botryodiplodin but no detectable phaseolinone. PubMed: Acyclic Stereoselection in the Ortho Ester Claisen Rearrangement. PubMed: The antibiotic PSX-1 produced by Penicillium stipitatum is identical with botryodiplodin. PubMed: Absence of DNA breaks during repair of DNA-protein cross-links induced by the mycotoxin botryodiplodin in mammalian cells. PubMed: Repair of DNA-protein cross-links induced by the mycotoxin botryodiplodin in mammalian cells. PubMed: DNA-protein cross-linking by the mycotoxin, botryodiplodin, in mammalian cells. PubMed: Relationships between the biological effects and chemical structure of the genotoxic mycotoxin, botryodiplodin. PubMed: Effects of the mycotoxin botryodiplodin on mammalian cells in culture. PubMed: Mutagenicity of the mycotoxin botryodiplodin in the Salmonella typhimurium/microsomal activation test. PubMed: [Toxicological study on the metabolites of Penicillium carneo-lutescens]. PubMed: Immunosuppressive properties of the antibiotics cytostipin and vermiculine. PubMed: Stereochemistry and synthesis of the antileukemic agent botryodiplodin. PubMed: Botryodiplodin--a new antibiotic from Botryodiplodia theobromae. II. Production, isolation and biological properties.