Sangivamycin - ≥98% , CAS No.18417-89-5

CAS: 18417-89-5 Cat. No.: S339041 Fórmula: C₁₂H₁₅N₅O₅ Peso molecular: 309.28 Número CE: 634-052-6 PubChem CID: 14978

GRAU & PUREZA ≥98%

Synonyms

BRN 0626355 | 4-Amino-7-beta-D-ribofuranosyl-7H-pyrrolo(2,3-d)pyrimidine-5-carboxamide | 7H-Pyrrolo[2,3-d]pyrimidine-5-carboxamide, 4-amino-7-.beta.-D-ribofuranosyl- | Q27158840 | UNII-L8YQ8Z3T9T | 3nyn | L8YQ8Z3T9T | 4-Amino-7-.beta.-D-ribofuranosyl-7H-p

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Visão geral

Sangivamycin is a cytotoxic purine nucleoside active against human cytomegalovirus (HCMV). Sangivamycin is also a selective and potent PKC (protein kinase C) inhibitor (IC|50|= 10μM). The inhibition is competitive with respect to ATP and non-competitive with respect to histone and lipid cofactors. The phosphorylation of histone H1 protein is a mechanism by which Sangivamycin prevents the cell growth and acts as cytotoxic agent against a variety of human cancers.

Product description

Sangivamycin, a nucleoside analog, is a potent inhibitor of protein kinase C (PKC) with an Ki of 10 μM. Sangivamycin has potent antiproliferative activity against a variety of human cancers.

Especificações

Sinónimos

BRN 0626355 | 4-Amino-7-beta-D-ribofuranosyl-7H-pyrrolo(2,3-d)pyrimidine-5-carboxamide | 7H-Pyrrolo[2,3-d]pyrimidine-5-carboxamide, 4-amino-7-.beta.-D-ribofuranosyl- | Q27158840 | UNII-L8YQ8Z3T9T | 3nyn | L8YQ8Z3T9T | 4-Amino-7-.beta.-D-ribofuranosyl-7H-p

Especificações e pureza

≥98%

Condições de armazenamento de armazenamento

Store at -20°C

Enviado em

Ice chest + Ice pads

Este produto requer transporte de cadeia fria. Serviços terrestres e outros serviços econômicos não estão disponíveis.

Pureza

≥98%

Propriedades do produto

Dados Ki

GRK 1: Ki= 180 nM (human); GRK 2: Ki= 67 μM (human)

Nomes e identificadores

Pubchem Sid

528767255

Sorrisos canónicos

C1=C(C2=C(N=CN=C2N1C3C(C(C(O3)CO)O)O)N)C(=O)N

IUPAC Name

4-amino-7-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrrolo[2,3-d]pyrimidine-5-carboxamide

InChIKey

OBZJZDHRXBKKTJ-JTFADIMSSA-N

INCHI

1S/C12H15N5O5/c13-9-6-4(10(14)21)1-17(11(6)16-3-15-9)12-8(20)7(19)5(2-18)22-12/h1,3,5,7-8,12,18-20H,2H2,(H2,14,21)(H2,13,15,16)/t5-,7-,8-,12-/m1/s1

SMILES isoméricas

C1=C(C2=C(N=CN=C2N1[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)O)N)C(=O)N

WGK Alemanha

3

RTECS

UY9355000

PubChem CID

14978

Peso molecular

309.28

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Nucleosides, nucleotides, and analogues
    • Classe Pyrrolopyrimidine nucleosides and nucleotides

• Kingdom: Organic compounds
• Superclass: Nucleosides, nucleotides, and analogues
• Classe: Pyrrolopyrimidine nucleosides and nucleotides
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Pyrrolopyrimidine nucleosides and nucleotides
• Alternative Parents: Glycosylamines Pentoses Pyrimidinecarboxamides Pyrrolo[2,3-d]pyrimidines Pyrrole carboxamides Aminopyrimidines and derivatives Substituted pyrroles Imidolactams Tetrahydrofurans Heteroaromatic compounds Vinylogous amides Amino acids and derivatives Primary carboxylic acid amides Secondary alcohols Oxacyclic compounds Azacyclic compounds Primary amines Primary alcohols Organopnictogen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Pyrrolopyrimidine ribonucleoside - Glycosyl compound - N-glycosyl compound - Pentose monosaccharide - Pyrrolo[2,3-d]pyrimidine - Pyrimidinecarboxamide - Pyrrolopyrimidine - Pyrrole-3-carboxamide - Pyrrole-3-carboxylic acid or derivatives - Aminopyrimidine - Monosaccharide - Pyrimidine - Substituted pyrrole - Imidolactam - Vinylogous amide - Pyrrole - Tetrahydrofuran - Heteroaromatic compound - Amino acid or derivatives - Secondary alcohol - Carboxamide group - Primary carboxylic acid amide - Azacycle - Organoheterocyclic compound - Oxacycle - Carboxylic acid derivative - Organooxygen compound - Organonitrogen compound - Alcohol - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Amine - Organic oxide - Primary alcohol - Primary amine - Hydrocarbon derivative - Aromatic heteropolycyclic compound
• Descrição: This compound belongs to the class of organic compounds known as pyrrolopyrimidine nucleosides and nucleotides. These are nucleoside derivatives containing a ribose derivative which is n-glycosylated to a pyrrolopyrimidine. Also called deazapurine nucleosides, they are analogs of purine nucleosides with the N atom of the purine being replaced by a C atom at position 7.
• External Descriptors: nucleoside analogue

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

Alvos associados (humanos)

MAOA Tclin Monoamine oxidase A (11911 Activities)

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JUN Tchem Proto-oncogene c-JUN (434 Activities)

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ADK Tchem Adenosine kinase (1481 Activities)

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GRK2 Tchem G-protein coupled receptor kinase 2 (1019 Activities)

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MCF-10A (2462 Activities)

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MDA-MB-468 (9477 Activities)

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HFF (3142 Activities)

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KB (17409 Activities)

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HeLa (62764 Activities)

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MDA-MB-231 (73002 Activities)

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BCL2L1 Tchem Apoptosis regulator Bcl-X (2604 Activities)

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GRK1 Tchem Rhodopsin kinase (359 Activities)

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DOT1L Tchem Histone-lysine N-methyltransferase, H3 lysine-79 specific (648 Activities)

Discover Target: DOT1L

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Alvos associados (não humanos)

Plasmodium falciparum (966862 Activities)

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Human alphaherpesvirus 2 (4932 Activities)

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Human respirovirus 3 (1674 Activities)

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Human betaherpesvirus 5 (5122 Activities)

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Oryctolagus cuniculus (11301 Activities)

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Vaccinia virus (4609 Activities)

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Human alphaherpesvirus 1 (11089 Activities)

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Poliovirus 1 (1274 Activities)

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Sindbis virus (1599 Activities)

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Vesicular stomatitis virus (4460 Activities)

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Coxsackievirus B4 (2249 Activities)

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L1210 (27553 Activities)

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Vero (26788 Activities)

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Mammalian orthoreovirus 1 (1523 Activities)

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HSPA8 Heat shock cognate 71 kDa protein (1 Activities)

Discover Target: HSPA8

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Mecanismos de ação

Propriedades químicas e físicas

• Solubilidade: Soluble in cold water, and 0.1 M KOH.
• Índice de refração: n20D1.89 (Predicted)
• Ponto de ebulição (°C): 880.6° C at 760 mmHg (Predicted)
• Peso molecular: 309.280 g/mol
• XLogP3: -2.500
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 3
• Exact Mass: 309.107 Da
• Monoisotopic Mass: 309.107 Da
• Topological Polar Surface Area: 170.000 Ų
• Heavy Atom Count: 22
• Formal Charge: 0
• Complexity: 440.000
• 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