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Altenusin

CAT: 0013-GTR19167032-03Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19167032-03Size:10 mg
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Description
Altenusin is a fungal metabolite that acts as a selective FXR agonist with an EC50 of 3.2 μM. This small molecule is a valuable research tool for investigating FXR-related pathways in metabolic and liver diseases, applicable in both in vitro and in vivo experimental models.
CAS Number
31186-12-6
Product Name Alternative
Altenusin, Alutenusin, inhibit, Inhibitor, FXR
Field of Research
Metabolism Research
Purity
97.20% (May vary between batches)
Solubility
DMSO:50 mg/mL (172.25 mM)
Smiles
C (O) (=O) C1=C (C=C (OC) C=C1O) C2=C (C) C=C (O) C (O) =C2
Molecular Formula
C15H14O6
Molecular Weight
290.27
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Altenusin

Altenusin is a carboxybiphenyl that is [biphenyl]-2-carboxylic acid which is substituted by a hydroxy group at positions 3, 4' and 5', methoxy group at position 5 and a methyl group at position 2'. It is a a metabolite isolated from Alternaria and several other fungal species. It has a role as an antifungal agent and a fungal metabolite. It is a carboxybiphenyl, a member of hydroxybiphenyls, a polyphenol, a member of catechols and an aromatic ether.

CAS Number31186-12-6
PubChem CID6918469
IUPAC Name2-(4,5-dihydroxy-2-methylphenyl)-6-hydroxy-4-methoxybenzoic acid
Molecular FormulaC15H14O6
Molecular Weight290.27
XLogP2.9
Topological Polar Surface Area107
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count6
Rotatable Bond Count3
Heavy Atom Count21
Formal Charge0
Complexity373
SMILES
CC1=CC(=C(C=C1C2=C(C(=CC(=C2)OC)O)C(=O)O)O)O
InChI
InChI=1S/C15H14O6/c1-7-3-11(16)12(17)6-9(7)10-4-8(21-2)5-13(18)14(10)15(19)20/h3-6,16-18H,1-2H3,(H,19,20)
InChIKey
ADPBTBPPIIKLEH-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Altenusin
CAS: 31186-12-6
CID: 6918469
Formula: C15H14O6
MW: 290.27
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight290.27
XLogP32.9
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count6
Rotatable Bond Count3
Exact Mass290.07903816
Monoisotopic Mass290.07903816
Topological Polar Surface Area107 Ų
Heavy Atom Count21
Formal Charge0
Complexity373
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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