CAS 232925-18-7

N-[5-[(1E)-2-Bromoethenyl]-2′-deoxy-P-phenyl-5′-uridylyl]-L-alanine methyl ester

Description:

N-[5-[(1E)-2-Bromoethenyl]-2′-deoxy-P-phenyl-5′-uridylyl]-L-alanine methyl ester is a synthetic compound that belongs to the class of modified nucleotides. This substance features a unique structure that incorporates a bromovinyl group, which can enhance its reactivity and potential biological activity. The presence of the 2′-deoxy and uridylyl components suggests that it may interact with nucleic acids, potentially influencing processes such as transcription or translation. The L-alanine methyl ester moiety indicates that it may also exhibit properties typical of amino acids, possibly affecting its solubility and interaction with proteins. The compound's CAS number, 232925-18-7, allows for precise identification in chemical databases. Its characteristics, including solubility, stability, and reactivity, would depend on the specific conditions under which it is studied, such as pH and temperature. Overall, this compound may have applications in biochemical research, particularly in the study of nucleic acid interactions and the development of novel therapeutic agents.

Formula: C₂₁H₂₅BrN₃O₉P

InChI: InChI=1S/C21H25BrN3O9P/c1-13(20(28)31-2)24-35(30,34-15-6-4-3-5-7-15)32-12-17-16(26)10-18(33-17)25-11-14(8-9-22)19(27)23-21(25)29/h3-9,11,13,16-18,26H,10,12H2,1-2H3,(H,24,30)(H,23,27,29)/b9-8+/t13-,16-,17+,18+,35?/m0/s1

InChI key: InChIKey=CFBLUORPOFELCE-BACVZHSASA-N

SMILES: O=C1N(C=C(/C=C/Br)C(=O)N1)[C@@H]2O[C@H](COP(OC3=CC=CC=C3)(N[C@H](C(OC)=O)C)=O)[C@@H](O)C2

Synonyms:

• L-Alanine, N-[5-[(1E)-2-bromoethenyl]-2′-deoxy-P-phenyl-5′-uridylyl]-, methyl ester
• NB 1011
• NB-1011
• methyl (2S)-2-{[{[(2R,3S,5R)-5-{5-[(E)-2-bromoethenyl]-2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl}-3-hydroxytetrahydrofuran-2-yl]methoxy}(phenoxy)phosphoryl]amino}propanoate (non-preferred name)
• Thymectacin
• N-[5-[(1E)-2-Bromoethenyl]-2′-deoxy-P-phenyl-5′-uridylyl]-L-alanine methyl ester
• NB-101

Thymectacin

CAS: 232925-18-7

Thymectacin

Purity: ≥95%

Molecular weight: 574.32g/mol

Ref: 54-BUP03428

Thymectacin

CAS: 232925-18-7

Thymectacin (NB 1011) is a selective thymidine synthase (TS) inhibitor with anticancer activity for the study of colon cancer and solid tumors.

Formula: C₂₁H₂₅BrN₃O₉P

Purity: 97.05% - 99.49%

Color and Shape: Solid

Molecular weight: 574.32

Ref: TM-T24881