6-Methylpurine - ≥97% , CAS No.2004-03-7

CAS: 2004-03-7 Cat. No.: M333680 Summenformel: C₆H₆N₄ Molekulargewicht: 134.14 EG-Nummer: 217-903-2

GRADE & PURITY ≥97%

Synonyms

UNII-SEO6WX0OZG | 6-Methylpurine | W-200569 | NCGC00188229-01 | DB02113 | SCHEMBL129804 | SEO6WX0OZG | CHEBI:40274 | Epitope ID:167472 | Q27093181 | 1H-Purine, 6-methyl- | BDBM92423 | PU10 | 6-Methylpurine, >=99% | 1h-purine,6-methyl- | DTXSID6073283 | 6-

Storage

Protected from light,Store at -20°C

Shipped In

Ice chest + Ice pads

Übersicht

Application：

6-Methylpurine (MeP) is a toxic adenine analog used as a bisubstrate inhibitor of enzymes that bind adenosyl moieties and which may become phosphorylated to levels that inhibit RNA and protein synthesis.

Specifications

Synonyme

UNII-SEO6WX0OZG | 6-Methylpurine | W-200569 | NCGC00188229-01 | DB02113 | SCHEMBL129804 | SEO6WX0OZG | CHEBI:40274 | Epitope ID:167472 | Q27093181 | 1H-Purine, 6-methyl- | BDBM92423 | PU10 | 6-Methylpurine, >=99% | 1h-purine,6-methyl- | DTXSID6073283 | 6-

Spezifikationen & Reinheit

≥97%

Storage

Protected from light,Store at -20°C

Verschickt in

Ice chest + Ice pads

Dieses Produkt erfordert Kühlkettenversand. Grundversand und andere Economy-Optionen sind nicht verfügbar.

Reinheit

≥97%

Produkteigenschaften

pKa

pKₐ: 9.53 (Predicted), pKₐ: 3.51 (Predicted)

Namen und Kennungen

Pubchem Sid

508810188

Kanonisches Lächeln

CC1=C2C(=NC=N1)N=CN2

IUPAC Name

6-methyl-7H-purine

InChIKey

SYMHUEFSSMBHJA-UHFFFAOYSA-N

INCHI

1S/C6H6N4/c1-4-5-6(9-2-7-4)10-3-8-5/h2-3H,1H3,(H,7,8,9,10)

Isomere SMILES

CC1=C2C(=NC=N1)N=CN2

WGK Deutschland

3

RTECS

UO8700000

Molekulargewicht

134.14

Reaxy-Rn

4552

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=4552&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Klasse Imidazopyrimidines
      • Subclass Purines and purine derivatives

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Klasse: Imidazopyrimidines
• Subclass: Purines and purine derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Purines and purine derivatives
• Alternative Parents: Pyrimidines and pyrimidine derivatives Imidazoles Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Purine - Pyrimidine - Heteroaromatic compound - Imidazole - Azole - Azacycle - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Aromatic heteropolycyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as purines and purine derivatives. These are aromatic heterocyclic compounds containing a purine moiety, which is formed a pyrimidine-ring ring fused to an imidazole ring.
• External Descriptors: purines

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

Zugehörige Ziele (menschlich)

HepG2 (196354 Activities)

Explore this target

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

TDP1 Tchem Tyrosyl-DNA phosphodiesterase 1 (345557 Activities)

Discover Target: TDP1

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

SMAD3 Tchem Mothers against decapentaplegic homolog 3 (68039 Activities)

Discover Target: SMAD3

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

Zugehörige Ziele (nicht menschlich)

Nfe2l2 Nuclear factor erythroid 2-related factor 2 (214 Activities)

Discover Target: Nfe2l2

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

Wirkungsmechanismen

Chemische und physikalische Eigenschaften

• Löslichkeit: Soluble in water (50 mg/ml), methanol, warm ethanol, and hot Isoproponal.
• Empfindlichkeit: Light sensitive
• Brechungsindex: n20D1.70 (Predicted)
• Siedepunkt (°C): ~410.9° C at 760 mmHg (Predicted) (tautomer)
• Schmelzpunkt (°C): 237-238° C (lit.)
• Molekulargewicht: 134.140 g/mol
• XLogP3: 0.500
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 134.059 Da
• Monoisotopic Mass: 134.059 Da
• Topological Polar Surface Area: 54.500 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 127.000
• 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