01338

Bergamottin

analytical standard

• Synonym(s): Bergamotine, Bergaptin
• Empirical Formula (Hill Notation): C₂₁H₂₂O₄
• CAS Number: 7380-40-7
• Molecular Weight: 338.40
• UNSPSC Code: 85151701
• NACRES: NA.24
• PubChem Substance ID: 329747253
• MDL number: MFCD00017409
• Beilstein/REAXYS Number: 1353914

Properties

• grade: analytical standard
• Quality Segment: 100
• assay: ≥98.0% (HPLC)
• technique(s): HPLC: suitable, gas chromatography (GC): suitable
• mp: 75-80 °C
• application(s): food and beverages
• format: neat
• storage temp.: 2-8°C
• SMILES string: C\C(C)=C\CC\C(C)=C\COc1c2C=CC(=O)Oc2cc3occc13
• InChI: 1S/C21H22O4/c1-14(2)5-4-6-15(3)9-11-24-21-16-7-8-20(22)25-19(16)13-18-17(21)10-12-23-18/h5,7-10,12-13H,4,6,11H2,1-3H3/b15-9+
• InChI key: DBMJZOMNXBSRED-OQLLNIDSSA-N

Description

General description

Bergamottin, a member of the furanocoumarin family, is primarily found in grapefruit juice. It is reported to be a novel signal transducer and activator of the transcription 3 (STAT3) inhibitor. It is a known drug inhibitor of cytochrome P450 34A and also exhibits diverse anti-tumor and anti-inflammatory activities.

Application

Bergamottin may be used as an analytical standard to test its efficacy in the following:

• Blocker of STAT3 activation pathway in tumor cells; its potential in the therapy of multiple myeloma (MM) and other cancers is investigated.
• Prevention and the treatment of cancer via suppression of the NF-kB signaling pathway and its regulated gene products.

Packaging

Bottomless glass bottle. Contents are inside inserted fused cone.

Other Notes

Find a digital Reference Material for this product available on our online platform ChemisTwin® for NMR. You can use this digital equivalent on ChemisTwin® for your sample identity confirmation and compound quantification (with digital external standard). An NMR spectrum of this substance can be viewed and an online comparison against your sample can be performed with a few mouseclicks. Learn more here and start your free trial.

Safety Information

• Storage Class: 11 - Combustible Solids
• wgk: WGK 3
• flash_point_f: Not applicable
• flash_point_c: Not applicable
• ppe: Eyeshields, Gloves, type N95 (US)