ChemicalBook--->CAS DataBase List--->16503-32-5

16503-32-5

16503-32-5 Structure

16503-32-5 Structure
IdentificationBack Directory
[Name]

Brevilin A
[CAS]

16503-32-5
[Synonyms]

Brevilin A
6-O-Angeloylplenolin
2-Butenoic acid,2-methyl-,(3S,3aR,4S,4aR,7aR,8R,9aR)-2,3,3a,4,4a,5,7a,8,9,9a-decahydro-3,4a,8-trimethyl-2,5-dioxoazuleno[6,5-b]furan-4-ylester, (2Z)-
[Molecular Formula]

C20H26O5
[MDL Number]

MFCD04034623
[MOL File]

16503-32-5.mol
[Molecular Weight]

346.42
Chemical PropertiesBack Directory
[Boiling point ]

494.0±45.0 °C(Predicted)
[density ]

1.17±0.1 g/cm3(Predicted)
[storage temp. ]

Sealed in dry,2-8°C
[solubility ]

DMSO:100.0(Max Conc. mg/mL);288.67(Max Conc. mM)
[form ]

A solid
[color ]

White to off-white
[InChIKey]

KUPPZVXLWANEJJ-UXPPPGSFSA-N
[SMILES]

C(O[C@H]1[C@]2([H])[C@H](C)C(=O)O[C@]2([H])C[C@@H](C)[C@@]2([H])[C@@]1(C)C(=O)C=C2)(=O)/C(/C)=C\C
Safety DataBack Directory
[Symbol(GHS) ]


GHS07
[Signal word ]

Warning
[Hazard statements ]

H317
[Precautionary statements ]

P280-P302+P352
Hazard InformationBack Directory
[Uses]

Brevilin A can be used using a selective extraction method to obtain natural substances, and can also be applied to prepare derivatives to use for anti-cancer activity.
[General Description]

This substance is a primary reference substance with assigned absolute purity (considering chromatographic purity, water, residual solvents, inorganic impurities). The exact value can be found on the certificate. Produced by PhytoLab GmbH & Co. KG
[Enzyme inhibitor]

This naturally occurring sesquiterpenoid (FW = 346.40 g/mol; CAS 16503- 32-5) from the volatile oils of the plant Centipeda minima inhibits (IC50 = 10 μg/mL) STAT3 phosphorylation in the Jak/STAT signal transduction pathway of A549R cells. Brevilin A showed high specificity on Janus Kinase activity and following STAT3 signaling without directly affecting some other signals, including p65, AKT and GSK-3β phosphorylation, as well as Src kinase activity. Brevilin A is also an antibiotic with activity against Giardia (IC50 = 16 μM) and Entamoeba histolitica (IC50 = 4–9 μM).
Spectrum DetailBack Directory
[Spectrum Detail]

Brevilin A(16503-32-5)1HNMR
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