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Atranorin - 99%, high purity , CAS No.479-20-9

  • Cas Number:  479-20-9
  • Molecular Weight:  374.34
  • PubChem CID: 68066
In stock
Item Number
A651753
Grouped product items
SKU Size
Availability
Price Qty
A651753-1mg
1mg
Available within 8-12 weeks(?)
Production requires sourcing of materials. We appreciate your patience and understanding.
$63.90
A651753-5mg
5mg
Available within 8-12 weeks(?)
Production requires sourcing of materials. We appreciate your patience and understanding.
$162.90
A651753-10mg
10mg
Available within 8-12 weeks(?)
Production requires sourcing of materials. We appreciate your patience and understanding.
$273.90

Phenols Polyphenols

Basic Description

Synonyms 3-Hydroxy-4-(methoxycarbonyl)-2,5-dimethylphenyl 3-formyl-2,4-dihydroxy-6-methylbenzoate | BSPBio_003332 | SR-05000002629 | CCG-38801 | NCGC00095465-01 | Q27258788 | Antranoric acid | Atranorine | Benzoic acid, 3-formyl-2,4-dihydroxy-6-methyl-, 3-hydroxy-
Specifications & Purity Moligand™, ≥98%
Biochemical and Physiological Mechanisms Atranorin is a lichen secondary metabolite. Atranorin inhibits lung cancer cell motility and tumorigenesis by affecting AP-1 , Wnt , and STAT signaling and suppressing RhoGTPase activity.
Storage Temp Protected from light,Store at -20°C,Argon charged
Shipped In
Ice chest + Ice pads
This product requires cold chain shipping. Ground and other economy services are not available.
Grade Moligand™
Product Description

Atranorin is a lichen secondary metabolite. Atranorin inhibits lung cancer cell motility and tumorigenesis by affecting AP-1 , Wnt , and STAT signaling and suppressing RhoGTPase activity

Form:Solid

IC50& Target:RhoGTPase

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
Superclass Phenylpropanoids and polyketides
Class Depsides and depsidones
Subclass Not available
Intermediate Tree Nodes Not available
Direct Parent Depsides and depsidones
Alternative Parents p-Hydroxybenzoic acid esters  o-Hydroxybenzoic acid esters  Phenol esters  Salicylic acid and derivatives  Hydroxybenzaldehydes  p-Xylenols  p-Xylenes  Resorcinols  Phenoxy compounds  Ortho cresols  Meta cresols  Benzoyl derivatives  1-hydroxy-4-unsubstituted benzenoids  1-hydroxy-2-unsubstituted benzenoids  Toluenes  Dicarboxylic acids and derivatives  Methyl esters  Vinylogous acids  Organic oxides  Hydrocarbon derivatives  
Molecular Framework Aromatic homomonocyclic compounds
Substituents Depside backbone - P-hydroxybenzoic acid ester - O-hydroxybenzoic acid ester - Dihydroxybenzoic acid - Benzoate ester - Phenol ester - Salicylic acid or derivatives - P-xylenol - Xylenol - Benzoic acid or derivatives - Hydroxybenzaldehyde - Benzoyl - Phenoxy compound - M-cresol - P-xylene - O-cresol - Resorcinol - Benzaldehyde - Xylene - Phenol - Toluene - Aryl-aldehyde - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Benzenoid - Methyl ester - Vinylogous acid - Carboxylic acid ester - Carboxylic acid derivative - Aldehyde - Organooxygen compound - Organic oxide - Organic oxygen compound - Hydrocarbon derivative - Aromatic homomonocyclic compound
Description This compound belongs to the class of organic compounds known as depsides and depsidones. These are polycyclic compounds that is either a polyphenolic compound composed of two or more monocyclic aromatic units linked by an ester bond (depside), or a compound containing the depsidone structure (depsidone).
External Descriptors Not available

Associated Targets(Human)

CYP3A4 Tclin Cytochrome P450 3A4 (53859 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
HaCaT (4069 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
TDP1 Tchem Tyrosyl-DNA phosphodiesterase 1 (345557 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
SLCO1B1 Tchem Solute carrier organic anion transporter family member 1B1 (2672 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
SLCO1B3 Tchem Solute carrier organic anion transporter family member 1B3 (2517 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID

Associated Targets(non-human)

PTGES Prostaglandin E synthase (10 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
Ptpn1 Protein-tyrosine phosphatase 1B (270 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
pol Human immunodeficiency virus type 1 integrase (9041 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
Candida albicans (78123 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
Spodoptera littoralis (798 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
Athelia rolfsii (768 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
Macrophomina phaseolina (474 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
Pythium aphanidermatum (174 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
Rhizoctonia solani (2251 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
Globisporangium debaryanum (107 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
Fusarium udum (48 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID

Mechanisms of Action

Mechanism of Action Action Type target ID Target Name Target Type Target Organism Binding Site Name References

Names and Identifiers

IUPAC Name (3-hydroxy-4-methoxycarbonyl-2,5-dimethylphenyl) 3-formyl-2,4-dihydroxy-6-methylbenzoate
INCHI InChI=1S/C19H18O8/c1-8-5-12(21)11(7-20)17(23)15(8)19(25)27-13-6-9(2)14(18(24)26-4)16(22)10(13)3/h5-7,21-23H,1-4H3
InChIKey YLOYKYXNDHOHHT-UHFFFAOYSA-N
Smiles CC1=CC(=C(C(=C1C(=O)OC2=C(C(=C(C(=C2)C)C(=O)OC)O)C)O)C=O)O
Isomeric SMILES CC1=CC(=C(C(=C1C(=O)OC2=C(C(=C(C(=C2)C)C(=O)OC)O)C)O)C=O)O
PubChem CID 68066
Molecular Weight 374.34

Certificates(CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

6 results found

Lot Number Certificate Type Date Item
F2523228 Certificate of Analysis Dec 12, 2024 A651753
F2523230 Certificate of Analysis Dec 12, 2024 A651753
F2523231 Certificate of Analysis Dec 12, 2024 A651753
F2523232 Certificate of Analysis Dec 12, 2024 A651753
F2523233 Certificate of Analysis Dec 12, 2024 A651753
F2523234 Certificate of Analysis Dec 12, 2024 A651753

Chemical and Physical Properties

Solubility DMSO : 16.67 mg/mL (44.53 mM; ultrasonic and warming and heat to 60°C)
Sensitivity Light sensitive;Heat sensitive
Molecular Weight 374.300 g/mol
XLogP3 4.300
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 8
Rotatable Bond Count 6
Exact Mass 374.1 Da
Monoisotopic Mass 374.1 Da
Topological Polar Surface Area 130.000 Ų
Heavy Atom Count 27
Formal Charge 0
Complexity 564.000
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
The total count of all stereochemical bonds 0
Covalently-Bonded Unit Count 1

Solution Calculators

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