CAS 1969-54-6: Thymidylyl-(3′→5′)-thymidine

Description: Thymidylyl-(3′→5′)-thymidine, commonly referred to as dTTP (deoxythymidine triphosphate), is a nucleotide that plays a crucial role in DNA synthesis and cellular metabolism. It consists of a thymine base, a deoxyribose sugar, and three phosphate groups linked in a chain. The 3′ to 5′ phosphodiester bond indicates the directionality of the nucleotide, which is essential for its incorporation into DNA strands during replication. dTTP is a key building block for DNA, providing the necessary thymine residue for base pairing with adenine during the synthesis process. In addition to its structural role, dTTP is involved in various biochemical pathways, including energy transfer and signaling. Its synthesis and regulation are critical for maintaining proper cellular function and genetic integrity. The CAS number 1969-54-6 uniquely identifies this compound in chemical databases, facilitating its study and application in research and biotechnology. Overall, thymidylyl-(3′→5′)-thymidine is vital for genetic information storage and transmission in living organisms.

Formula: C₂₀H₂₇N₄O₁₂P

InChI: InChI=1S/C20H27N4O12P/c1-9-5-23(19(29)21-17(9)27)15-3-11(26)14(35-15)8-33-37(31,32)36-12-4-16(34-13(12)7-25)24-6-10(2)18(28)22-20(24)30/h5-6,11-16,25-26H,3-4,7-8H2,1-2H3,(H,31,32)(H,21,27,29)(H,22,28,30)/t11-,12-,13+,14+,15+,16+/m0/s1

InChI key: InChIKey=FCXGCSBZKOHCLB-KPRKPIBOSA-N

SMILES: O=C1NC(=O)N(C=C1C)C2OC(COP(=O)(O)OC3CC(OC3CO)N4C=C(C(=O)NC4=O)C)C(O)C2

Synonyms:

• 5′-Thymidylic acid, 3′-ester with thymidine
• Thymidine, thymidylyl-(3'-5')-
• Thymidylyl (3',5')-ribothymidine
• Thymidylyl-(3'-5')-thymidine
• Tp5meU
• bis{[(2R,3S,5R)-3-hydroxy-5-(5-methyl-2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)tetrahydrofuran-2-yl]methyl} hydrogen phosphate (non-preferred name)
• d(Tpt)
• dTpdT
• TpT

Thymidylyl(3′-5′)thymidine ammonium salt

CAS: 1969-54-6

• Formula: C₂₀H₂₇N₄O₁₂P·NH₃
• Purity: (HPLC) ≥ 98.0%
• Color and Shape: White to off-white powder
• Molecular weight: 563.45

B-D-Threo-thymidylyl-(3'→5')-B-D-threo-thymidine-13C2 Ammonia Salt

CAS: 1969-54-687367-14-4

• Formula: C₁₈C₂H₂₇N₄O₁₂P·NH₃
• Color and Shape: Neat
• Molecular weight: 565.44

Thymidylyl-3'-5'-thymidine Triethyl Amine Salt

CAS: 1969-54-6

• Formula: C₂₀H₂₇N₄O₁₂P·xC₆H₁₅N
• Color and Shape: Neat
• Molecular weight: 647.612

Thymidylyl-(3′→5′)-thymidine ammonium salt

CAS: 1969-54-6

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• Formula: C₂₀H₃₀N₅O₁₂P
• Purity: Min. 95%
• Molecular weight: 563.5 g/mol