Crotonoside - ≥95%(HPLC) , CAS No.1818-71-9

CAS: 1818-71-9 Cat. No.: C168062 分子式: C₁₀H₁₃N₅O₅ 分子量: 283.24 PubChem CID: 65085

GRADE & PURITY ≥95%(HPLC)

Synonyms

9H-Purin-2-ol, 6-amino-9-beta-D-ribofuranosyl- | Adenosine, 1,2-dihydro-2-oxo- | C08432 | 2-Oxo-3-hydroadenosine | 6-amino-9-((2S,3S,4R,5S)-3,4-dihydroxy-5-(hydroxymethyl)-tetrahydrofuran-2-yl)-3H-purin-2(9H)-one;9-?-D-Ribofuranosylisoguanine | MFCD049719

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

概要

Crotonoside, or isoguanosine, is a naturally occurring active isomer of guanosine that is found in the seeds of Croton tiglium.

Specifications

同義語

9H-Purin-2-ol, 6-amino-9-beta-D-ribofuranosyl- | Adenosine, 1,2-dihydro-2-oxo- | C08432 | 2-Oxo-3-hydroadenosine | 6-amino-9-((2S,3S,4R,5S)-3,4-dihydroxy-5-(hydroxymethyl)-tetrahydrofuran-2-yl)-3H-purin-2(9H)-one;9-?-D-Ribofuranosylisoguanine | MFCD049719

仕様と純度

≥95%(HPLC)

生化学的・生理学的メカニズム

Crotonoside, or isoguanosine, is a naturally occurring active isomer of guanosine that is found in the seeds of Croton tiglium, which is used in Traditional Chinese Medicine. It has shown more activity than adenosine in reducing the blood pressure of rabb

保管条件

Store at -20°C

入荷

Ice chest + Ice pads

この製品は冷冷この冷このこの製品の運送が必要です。地上およびその他の経済サービスは利用できません。

アクションタイプ

INHIBITOR

純度

≥95%(HPLC)

名前と識別子

パブケム・シド

504753956

パブケム・シド・ウル

https://pubchem.ncbi.nlm.nih.gov/substance/504753956

カノニカル・スマイル

C1=NC2=C(NC(=O)N=C2N1C3C(C(C(O3)CO)O)O)N

IUPAC Name

6-amino-9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1H-purin-2-one

InChIKey

MIKUYHXYGGJMLM-UUOKFMHZSA-N

INCHI

1S/C10H13N5O5/c11-7-4-8(14-10(19)13-7)15(2-12-4)9-6(18)5(17)3(1-16)20-9/h2-3,5-6,9,16-18H,1H2,(H3,11,13,14,19)/t3-,5-,6-,9-/m1/s1

異性体SMILES

C1=NC2=C(NC(=O)N=C2N1[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)O)N

PubChem CID

65085

分子量

283.24

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Nucleosides, nucleotides, and analogues
    • 分類 Purine nucleosides

• Kingdom: Organic compounds
• Superclass: Nucleosides, nucleotides, and analogues
• 分類: Purine nucleosides
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Purine nucleosides
• Alternative Parents: Glycosylamines 6-aminopurines Pentoses Aminopyrimidines and derivatives Hydroxypyrimidines Imidolactams N-substituted imidazoles Tetrahydrofurans Heteroaromatic compounds Secondary alcohols Azacyclic compounds Oxacyclic compounds Primary alcohols Hydrocarbon derivatives Primary amines Organopnictogen compounds
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Purine nucleoside - N-glycosyl compound - Glycosyl compound - 6-aminopurine - Pentose monosaccharide - Purine - Imidazopyrimidine - Aminopyrimidine - Hydroxypyrimidine - N-substituted imidazole - Imidolactam - Pyrimidine - Monosaccharide - Imidazole - Tetrahydrofuran - Azole - Heteroaromatic compound - Secondary alcohol - Oxacycle - Azacycle - Organoheterocyclic compound - Primary amine - Amine - Alcohol - Organic nitrogen compound - Hydrocarbon derivative - Organopnictogen compound - Organic oxygen compound - Primary alcohol - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
• 説明: This compound belongs to the class of organic compounds known as purine nucleosides. These are compounds comprising a purine base attached to a ribosyl or deoxyribosyl moiety.
• External Descriptors: purine nucleoside

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

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Discover Target: Adora2b

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作用メカニズム

化学的性質と物理的性質

• 分子量: 283.240 g/mol
• XLogP3: -3.000
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 2
• Exact Mass: 283.092 Da
• Monoisotopic Mass: 283.092 Da
• Topological Polar Surface Area: 153.000 Ų
• Heavy Atom Count: 20
• Formal Charge: 0
• Complexity: 544.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 4
• 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