CAS 33377-72-9|theaflavine-3,3'-digallate

Introduction：Basic information about CAS 33377-72-9|theaflavine-3,3'-digallate, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.

Table of Contents

1. Names
2. theaflavine-3,3'-digallate BiologicalActivity
3. Chemical & Physical Properties
4. Synonyms

Common Name	theaflavine-3,3'-digallate
CAS Number	33377-72-9	Molecular Weight	868.702
Density	2.0±0.1 g/cm3	Boiling Point	1352.6±65.0 °C at 760 mmHg
Molecular Formula	C₄₃H₃₂O₂₀	Melting Point	/
MSDS	/	Flash Point	411.0±27.8 °C

Names

Name	theaflavine-3,3'-digallate
Synonym	More Synonyms

theaflavine-3,3'-digallate BiologicalActivity

Description	Theaflavine-3,3'-digallate, a bioactive black tea phenolic, can be used for the research of gut microbiota composition modulatory effects[1].
Related Catalog	Research Areas >>InfectionResearch Areas >>Metabolic DiseaseSignaling Pathways >>Anti-infection >>Bacterial
References	[1]. Zhibin Liu, et al. Microbial Metabolism of Theaflavin-3,3'-digallate and Its Gut Microbiota Composition Modulatory Effects. J Agric Food Chem. 2021 Jan 13;69(1):232-245.

Chemical & Physical Properties

Density	2.0±0.1 g/cm3
Boiling Point	1352.6±65.0 °C at 760 mmHg
Molecular Formula	C₄₃H₃₂O₂₀
Molecular Weight	868.702
Flash Point	411.0±27.8 °C
Exact Mass	868.148682
PSA	351.12000
LogP	6.23
Vapour Pressure	0.0±0.3 mmHg at 25°C
Index of Refraction	1.912

Synonyms

Benzoic acid, 3,4,5-trihydroxy-, (3,4,5-trihydroxy-6-oxo-6H-benzocycloheptene-1,8-diyl)bis(3,4-dihydro-5,7-dihydroxy-2H-1-benzopyran-2,3-diyl) ester

(3,4,5-Trihydroxy-6-oxo-6H-benzo[7]annulene-1,8-diyl)bis(5,7-dihydroxy-3,4-dihydro-2H-chromene-2,3-diyl) bis(3,4,5-trihydroxybenzoate)

Benzoic acid, 3,4,5-trihydroxy-, (2R,3R)-2-[1-[(2S,3S)-3,4-dihydro-5,7-dihydroxy-3-[(3,4,5-trihydroxybenzoyl)oxy]-2H-1-benzopyran-2-yl]-3,4,6-trihydroxy-5-oxo-5H-benzocyclohepten-8-yl]-3,4-dihydro-5,7-dihydroxy-2H-1-benzopyran-3-yl ester

(2R,3R)-2-(1-{(2S,3S)-5,7-Dihydroxy-3-[(3,4,5-trihydroxybenzoyl)oxy]-3,4-dihydro-2H-chromen-2-yl}-3,4,6-trihydroxy-5-oxo-5H-benzo[7]annulen-8-yl)-5,7-dihydroxy-3,4-dihydro-2H-chromen-3-yl 3,4,5-trihydroxybenzoate

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