5-trans Prostaglandin E2 - ≥98% , CAS No.36150-00-2

CAS: 36150-00-2 Cat. No.: T355729 Peso molecular: 352.5 Número EC: 111-011-6

GRADE & PURITY ≥98%

Synonyms

SR-01000946421-1 | (5E)-PROSTAGLANDIN E2 | 5-trans-PGE2 | trans-Dinoprostone | UNII-6V30L285LP | PDSP2_001531 | (E)-7-((1R,2R,3R)-3-hydroxy-2-((S,E)-3-hydroxyoct-1-enyl)-5-oxocyclopentyl)hept-5-enoic acid | 5-trans Prostaglandin E2 | PD021141 | SR-0100094

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Descripción general

5-trans PGE2 is a naturally occuring compound and is a common impurity in commercial lots of PGE1, that shows a potency that is 18 times greater than PGE2 (5-cis PGE2) in cases of activation of adenylate cyclase in NCB-20 cell homogenates. Also has been shown to accelerate fibrinolysis by enhancing plasminogen activation mediated by tissue-type plasminogen activator, and to inhibit platelet aggregation in platelet rich plasma (PRP).

Specifications

Sinónimos

SR-01000946421-1 | (5E)-PROSTAGLANDIN E2 | 5-trans-PGE2 | trans-Dinoprostone | UNII-6V30L285LP | PDSP2_001531 | (E)-7-((1R, 2R, 3R)-3-hydroxy-2-((S, E)-3-hydroxyoct-1-enyl)-5-oxocyclopentyl)hept-5-enoic acid | 5-trans Prostaglandin E2 | PD021141 | SR-0100094

Especificaciones y pureza

≥98%

Condiciones de almacenamiento de almacenamiento

Store at -20°C

Enviado en

Ice chest + Ice pads

Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.

Pureza

≥98%

Nombres e identificadores

• Pubchem Sid: 504763455
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504763455
• Sonrisas canónicas: CCCCCC(C=CC1C(CC(=O)C1CC=CCCCC(=O)O)O)O
• IUPAC Name: (E)-7-[(1R,2R,3R)-3-hydroxy-2-[(E,3S)-3-hydroxyoct-1-enyl]-5-oxocyclopentyl]hept-5-enoic acid
• InChIKey: XEYBRNLFEZDVAW-BRNHSORCSA-N
• INCHI: 1S/C20H32O5/c1-2-3-6-9-15(21)12-13-17-16(18(22)14-19(17)23)10-7-4-5-8-11-20(24)25/h4,7,12-13,15-17,19,21,23H,2-3,5-6,8-11,14H2,1H3,(H,24,25)/b7-4+,13-12+/t15-,16+,17+,19+/m0/s1
• Isómeros SMILES: CCCCC[C@@H](/C=C/[C@H]1[C@@H](CC(=O)[C@@H]1C/C=C/CCCC(=O)O)O)O
• Peso molecular: 352.5
• Reaxy-Rn: 2705862
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2705862&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Lipids and lipid-like molecules
• Clase: 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 Cyclopentanols Cyclic ketones Cyclic alcohols and derivatives 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 - Cyclopentanol - Fatty acid - Unsaturated fatty acid - Cyclic alcohol - Ketone - Cyclic ketone - Secondary alcohol - Carboxylic acid - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Alcohol - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organooxygen compound - Carbonyl group - Aliphatic homomonocyclic compound
• Descripción: 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

Propiedades químicas y físicas

• Solubilidad: DMF: >100 mg/ml (from PGE2)；DMSO: >100 mg/ml (from PGE2)；Ethanol: >100 mg/ml (from PGE2)；PBS pH 7.2: >5 mg/ml (from PGE2)
• Peso molecular: 352.500 g/mol
• XLogP3: 2.800
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 12
• Exact Mass: 352.225 Da
• Monoisotopic Mass: 352.225 Da
• Topological Polar Surface Area: 94.800 Ų
• Heavy Atom Count: 25
• Formal Charge: 0
• Complexity: 469.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 4
• 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