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Chebulagic acid

Chebulagic acid structure

Chebulagic acid 

structure
  • CAS No:

    23094-71-5

  • Formula:

    C41H30O27

  • Chemical Name:

    Chebulagic acid

  • Synonyms:

    β-D-Glucopyranose,cyclic 3,6-[(1R)-4,4′,5,5′,6,6′-hexahydroxy[1,1′-biphenyl]-2,2′-dicarboxylate] 1-(3,4,5-trihydroxybenzoate),cyclic 2→2:4→1-ester with (2S)-2-[(3S,4S)-5-carboxy-3,4-dihydro-3,7,8-trihydroxy-2-oxo-2H-1-benzopyran-4-yl]butanedioic acid;β-D-Glucopyranose,cyclic 3,6-[(1R)-4,4′,5,5′,6,6′-hexahydroxy[1,1′-biphenyl]-2,2′-dicarboxylate] 1-(3,4,5-trihydroxybenzoate),cyclic 2→5:4→1-ester with (2S)-[(3S,4S)-5-carboxy-3,4-dihydro-3,7,8-trihydroxy-2-oxo-2H-1-benzopyran-4-yl]butanedioic acid;Chebulagic acid;β-D-Glucopyranose,cyclic 3,6-[(1R)-4,4′,5,5′,6,6′-hexahydroxy[1,1′-biphenyl]-2,2′-dicarboxylate] 1-(3,4,5-trihydroxybenzoate),cyclic 2→2:4→1-ester with (2S)-[(3S,4S)-5-carboxy-3,4-dihydro-3,7,8-trihydroxy-2-oxo-2H-1-benzopyran-4-yl]butanedioic acid;10,24-(Epoxymethano)-11H-dibenzo[8,9:10,11][1,6]dioxacyclododecino[2,3-d]pyrano[4,3,2-ij][2,6]benzodioxacycloundecin,β-D-glucopyranose deriv.;19293-38-0

  • Categories:

    Biochemical Engineering  >  Plant Extracts

Description

Chebulagic acid is a COX-LOX dual inhibitor isolated from the fruits of Terminalia chebula Retz, on angiogenesis.target: COX-LOX [1]In vitro: Chebulagic acid can enhance the autophagy. Chebulagic acid exert anti-inflammatory and anti-infective effects. [1] [2] Chebulagic acid also show a protective effect against 1-methyl-4-phenylpyridinium (MPP+) - induce cytotoxicity which mimics the pathological symptom of Parkinson's disease. Chebulagic acid inhibit the LPS-induced upregulation of TN

Chebulagic acid Basic Attributes

954.661

954.66

JW8L3F5IW9

Characteristics

447.09000

2.25

2.1±0.1 g/cm3

>300 °C @ Solvent: Water

1610.6±65.0 °C at 760 mmHg

480.0±27.8 °C

1.876

0mmHg at 25°C

Safety Information

NONH for all modes of transport

3

Drug Information

Compounds that bind to and inhibit that enzymatic activity of LIPOXYGENASES. Included under this category are inhibitors that are specific for lipoxygenase subtypes and act to reduce the production of LEUKOTRIENES. (See all compounds classified as Lipoxygenase Inhibitors.)|Compounds that inhibit the activity of DNA TOPOISOMERASE I. (See all compounds classified as Topoisomerase I Inhibitors.)

chebulagic acid

Computed Properties

Molecular Weight:954.7
XLogP3:0.4
Hydrogen Bond Donor Count:13
Hydrogen Bond Acceptor Count:27
Rotatable Bond Count:5
Exact Mass:954.09744568
Monoisotopic Mass:954.09744568
Topological Polar Surface Area:447
Heavy Atom Count:68
Complexity:1970
Defined Atom Stereocenter Count:7
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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