Prostaglandin J2 - Moligand™, ≥95%, 5 mg/mL in methyl acetate , Agonist of DP 1 receptor;Agonist of DP 2 receptor, CAS No.60203-57-8, Agonist of DP 1 receptor;Agonist of DP 2 receptor

CAS: 60203-57-8 Cat. No.: P275004 Molecular Weight: 334.45 PubChem CID: 5280884

GRADE & PURITY Moligand™, ≥95%, 5 mg/mL in methyl acetate

Synonyms

BDBM50594729 | C05957 | BML1-G07 | PGJ2 (Prostaglandin J2) | Prostaglandin J2 Lipid Maps(R) MS Standard | SR-05000002330-3 | 8-epi-15-J2t-IsoP | HMS1989K20 | LMFA03010019 | (5Z,13E,15S)-15-hydroxy-11-oxoprosta-5,9,13-trien-1-oic acid | CHEBI:27485 | GTPL1

Storage

Store at -80°C

Shipped In

Dry ice packs + Cold packs

Specifications

Synonyms

BDBM50594729 | C05957 | BML1-G07 | PGJ2 (Prostaglandin J2) | Prostaglandin J2 Lipid Maps(R) MS Standard | SR-05000002330-3 | 8-epi-15-J2t-IsoP | HMS1989K20 | LMFA03010019 | (5Z, 13E, 15S)-15-hydroxy-11-oxoprosta-5, 9, 13-trien-1-oic acid | CHEBI:27485 | GTPL1

Specifications & Purity

Moligand™, ≥95%, 5 mg/mL in methyl acetate

Biochemical and Physiological Mechanisms

Endogenous highly reactive product of inflammation. PGD 2 analog. Potent neurotoxin and activator of PPARα and PPARγ. Able to trigger pro-apoptotic responses in neuronal cells.

Storage

Store at -80°C

Shipped In

Dry ice packs + Cold packs

This product requires cold chain shipping. Ground and other economy services are not available.

Grade

Moligand™

Action Type

AGONIST

Mechanism of action

Agonist of DP 1 receptor;Agonist of DP 2 receptor

Note

Providing storage is as stated on the product vial and the vial is kept tightly sealed, the product can be stored for up to 6 months. Before use, and prior to opening the vial we recommend that you allow your product to equilibrate to room temperature for at least 1 hour. Need more advice on solubility, usage and handling? Please visit our frequently asked questions (FAQ) page for more details.

Purity

≥95%

Names and Identifiers

• Canonical Smiles: CCCCCC(C=CC1C(C=CC1=O)CC=CCCCC(=O)O)O
• IUPAC Name: (Z)-7-[(1S,5R)-5-[(E,3S)-3-hydroxyoct-1-enyl]-4-oxocyclopent-2-en-1-yl]hept-5-enoic acid
• InChIKey: UQOQENZZLBSFKO-POPPZSFYSA-N
• INCHI: 1S/C20H30O4/c1-2-3-6-10-17(21)13-14-18-16(12-15-19(18)22)9-7-4-5-8-11-20(23)24/h4,7,12-18,21H,2-3,5-6,8-11H2,1H3,(H,23,24)/b7-4-,14-13+/t16-,17-,18+/m0/s1
• Isomeric SMILES: CCCCC[C@@H](/C=C/[C@@H]1[C@H](C=CC1=O)C/C=C\CCCC(=O)O)O
• PubChem CID: 5280884
• Molecular Weight: 334.45

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Lipids and lipid-like molecules
    • Class Fatty Acyls
      • Subclass Eicosanoids

• Kingdom: Organic compounds
• Superclass: Lipids and lipid-like molecules
• Class: Fatty Acyls
• Subclass: Eicosanoids
• Intermediate Tree Nodes: Not available
• Direct Parent: Prostaglandins and related compounds
• Alternative Parents: Long-chain fatty acids Hydroxy fatty acids Unsaturated fatty acids Secondary alcohols Cyclic ketones Monocarboxylic acids and derivatives Carboxylic acids Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aliphatic homomonocyclic compounds
• Substituents: Prostaglandin skeleton - Long-chain fatty acid - Hydroxy fatty acid - Fatty acid - Unsaturated fatty acid - Ketone - Cyclic ketone - Secondary alcohol - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Organic oxide - Organic oxygen compound - Alcohol - Hydrocarbon derivative - Carbonyl group - Organooxygen compound - Aliphatic homomonocyclic compound
• Description: This compound belongs to the class of organic compounds known as prostaglandins and related compounds. These are unsaturated carboxylic acids consisting of a 20 carbon skeleton that also contains a five member ring, and are based upon the fatty acid arachidonic acid.
• External Descriptors: Prostaglandins

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Associated Targets(Human)

PTGDR Tclin Prostaglandin D2 receptor (1 Activities)

Discover Target: PTGDR

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

PTGDR2 Tchem Prostaglandin D2 receptor 2 (2 Activities)

Discover Target: PTGDR2

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

VDR Tclin Vitamin D receptor (26531 Activities)

Discover Target: VDR

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

UCHL3 Tchem Ubiquitin carboxyl-terminal hydrolase isozyme L3 (50 Activities)

Discover Target: UCHL3

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mechanisms of Action

Chemical and Physical Properties

• Solubility: Supplied in methyl acetate (5 mg/ml)
• Molecular Weight: 334.400 g/mol
• XLogP3: 3.600
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 12
• Exact Mass: 334.214 Da
• Monoisotopic Mass: 334.214 Da
• Topological Polar Surface Area: 74.600 Ų
• Heavy Atom Count: 24
• Formal Charge: 0
• Complexity: 476.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 3
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 2
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 2
• Covalently-Bonded Unit Count: 1