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CAS 129895-88-1

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2-Amino-1,9-dihydro-9-[(1R,4S)-4-[(phosphonooxy)methyl]-2-cyclopenten-1-yl]-6H-purin-6-one

Description:
2-Amino-1,9-dihydro-9-[(1R,4S)-4-[(phosphonooxy)methyl]-2-cyclopenten-1-yl]-6H-purin-6-one, with CAS number 129895-88-1, is a purine derivative characterized by its complex structure that includes an amino group and a cyclopentene moiety. This compound features a phosphonooxy group, which suggests potential applications in biochemistry, particularly in the context of nucleotide analogs or as a phosphonate. The presence of the cyclopentene ring contributes to its unique stereochemistry and reactivity. Typically, purine derivatives are known for their roles in biological systems, including DNA and RNA synthesis, and can exhibit various biological activities. The specific stereochemistry indicated by the (1R,4S) configuration may influence its interaction with biological targets, potentially affecting its pharmacological properties. Overall, this compound's structural features suggest it may be of interest in medicinal chemistry and drug development, particularly in the design of antiviral or anticancer agents.
Formula:C11H14N5O5P
InChI:InChI=1S/C11H14N5O5P/c12-11-14-9-8(10(17)15-11)13-5-16(9)7-2-1-6(3-7)4-21-22(18,19)20/h1-2,5-7H,3-4H2,(H2,18,19,20)(H3,12,14,15,17)/t6-,7+/m1/s1
InChI key:InChIKey=OJDRNVIJFVCXOM-RQJHMYQMSA-N
SMILES:O=C1C2=C(N(C=N2)[C@@H]3C[C@H](COP(=O)(O)O)C=C3)NC(N)=N1
Synonyms:
  • 6H-Purin-6-one, 2-amino-1,9-dihydro-9-[(1R,4S)-4-[(phosphonooxy)methyl]-2-cyclopenten-1-yl]-
  • 2-Amino-1,9-dihydro-9-[(1R,4S)-4-[(phosphonooxy)methyl]-2-cyclopenten-1-yl]-6H-purin-6-one
  • 6H-Purin-6-one, 2-amino-1,9-dihydro-9-[4-[(phosphonooxy)methyl]-2-cyclopenten-1-yl]-, (1R-cis)-
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