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Ecabet Sodium

CAT: 0013-GTR19173716-02Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19173716-02Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
Ecabet Sodium (TA-2711) is a research compound investigated for treating distal colitis. Studies indicate it promotes mucosal protection and healing, with applications in gastrointestinal disease research using both in vitro cell models and in vivo animal studies of intestinal inflammation.
CAS Number
86408-72-2
Product Name Alternative
Bacterial, Ecabet, Ecabet Sodium, inhibit, Inhibitor, TA 2711, TA2711, TA-2711, TA-2711E, ReactiveOxygenSpecies, Reactive Oxygen Species
Field of Research
Cell Biology, Immunology & Inflammation, Infectious Disease & Virology, Metabolism Research, Pharmacology & Drug Discovery, Signal Transduction
Purity
97.68% (May vary between batches)
Solubility
DMSO:50 mg/mL (124.23 mM) ;10% DMSO+40% PEG300+5% Tween 80+45% Saline:2 mg/mL (4.97 mM)
Smiles
[Na+].COC (=O) [C@@H]1CCC[C@@]2 (C) [C@@H]1CCc1cc (C (C) C) c (cc21) S ([O-]) (=O) =O
Molecular Formula
C20H27NaO5S
Molecular Weight
402.48
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Ecabet sodium
CAS Number86408-72-2
PubChem CID23663982
IUPAC Namesodium (4bS,8R,8aR)-8-carboxy-4b,8-dimethyl-2-propan-2-yl-5,6,7,8a,9,10-hexahydrophenanthrene-3-sulfonate
Molecular FormulaC20H27NaO5S
Molecular Weight402.5
Topological Polar Surface Area103
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Heavy Atom Count27
Formal Charge0
Complexity672
SMILES
CC(C)C1=C(C=C2C(=C1)CC[C@@H]3[C@@]2(CCC[C@@]3(C)C(=O)O)C)S(=O)(=O)[O-].[Na+]
InChI
InChI=1S/C20H28O5S.Na/c1-12(2)14-10-13-6-7-17-19(3,8-5-9-20(17,4)18(21)22)15(13)11-16(14)26(23,24)25;/h10-12,17H,5-9H2,1-4H3,(H,21,22)(H,23,24,25);/q;+1/p-1/t17-,19-,20-;/m1./s1
InChIKey
RCVIHORGZULVTN-YGJXXQMASA-M
Chemical Structure
2D Structure
2D structure of Ecabet sodium
CAS: 86408-72-2
CID: 23663982
Formula: C20H27NaO5S
MW: 402.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight402.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Exact Mass402.14768941
Monoisotopic Mass402.14768941
Topological Polar Surface Area103 Ų
Heavy Atom Count27
Formal Charge0
Complexity672
Isotope Atom Count0
Defined Atom Stereocenter Count3
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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MBS576618Ecabet Sodium
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A14028-100Ecabet sodium 100mg
A14028-5Ecabet sodium 5mg
A14028-500Ecabet sodium 500mg
A14028-200Ecabet sodium 200mg
A14028-50Ecabet sodium 50mg
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A14028-10Ecabet sodium 10mg

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