acevaltrate

acetoxyvaltrate

CAS: 25161-41-5 C24 H32 O10 MW: 480.51104000

Identification

Nameacevaltrate
IUPAC[(1S,6S,7R,7aS)-4-(acetyloxymethyl)-1-(3-methylbutanoyloxy)spiro[6,7a-dihydro-1H-cyclopenta[c]pyran-7,2'-oxirane]-6-yl] 3-acetyloxy-3-methylbutanoate
CAS Number25161-41-5
EINECS246-685-1
FDA UNIIS9MFK45GY9
Molecular FormulaC24 H32 O10
Molecular Weight480.51104000
Nikkaji NumberJ236.070E

Regulatory

Physical Properties

Assay 95.00 to 100.00
Food Chemicals Codex Listed No
Soluble in water, 9.669 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 acevaltrate usage levels up tonot for fragrance use.
Recommendation for acevaltrate flavor usage levels up tonot for flavor use.

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Potential Uses

None Found

Natural Occurrence

found in nature

Synonyms

acetovaltrate acetoxyvaltrate [(1S,6S,7R,7aS)-4-( acetyloxymethyl)-1-(3-methylbutanoyloxy)spiro[6,7a-dihydro-1H-cyclopenta[c]pyran-7,2'-oxirane]-6-yl] 3-acetyloxy-3-methylbutanoate acevaltratum 1,7a- dihydro-1,6-dihydroxyspiro(cyclopenta(c)pyran-7(6H), 2'-oxirane)-4-methanol 4-acetate 1(or 6)-isovalerate 6(or 1)-(3-hydroxy-3-methylbutyrate, acetate) PubMed: Flexible and powerful strategy for qualitative and quantitative analysis of valepotriates in Valeriana jatamansi Jones using high-performance liquid chromatography with linear ion trap Orbitrap mass spectrometry. PubMed: [Mass spectrum characterization of five valepotriates by electrospray ionization tandem mass spectrometry]. PubMed: Effect of storage time and conditions on the diene valepotriates content of the extract of Valeriana glechomifolia obtained by supercritical carbon dioxide. PubMed: In vitro effect of valepotriates isolated from Valeriana glechomifolia on rat P-type ATPases. PubMed: [Study on quality specification of Rhizoma et Radix Valeriana Jatamansi]. PubMed: Control of development and valepotriate production by auxins in micropropagated Valeriana glechomifolia. PubMed: [Interspecific and intraspecific comparison of valepotrates contents in three Valeriana plants]. PubMed: Iridoids from the rhizomes and roots of Valeriana jatamansi. PubMed: Quantitative determination of valepotriates from Valeriana native to South Brazil. PubMed: Cytotoxic potential of valerian constituents and valerian tinctures. PubMed: Effect of valepotriates on the behavior of rats in the elevated plus-maze during diazepam withdrawal. PubMed: Valerian-derived sedative agents. I. On the structure and spectral assignment of the constituents of valmane using the selective INEPT nuclear magnetic resonance technique. PubMed: The Structure of New Valepotriates from Tissue Cultures of Valeriana wallichii. PubMed: Valepotriate content in different in vitro cultures of Valerianaceae and characterization of Valeriana officinalis L. callus during a growth period. PubMed: HPCL Separation and quantitative determination of valepotriates from Valeriana kilimandascharica. PubMed: Mass spectrometry of valepotriates.