Triphosphoric acid, P-[[(1S,4R)-4-(2-amino-1,6-dihydro-6-oxo-9H-purin-9-yl)-2-cyclopenten-1-yl]methyl] ester

CAS Registry Number®

129941-14-6

CAS Name

Triphosphoric acid, P-[[(1S,4R)-4-(2-amino-1,6-dihydro-6-oxo-9H-purin-9-yl)-2-cyclopenten-1-yl]methyl] ester

Molecular Formula

C11H16N5O11P3

Molecular Mass

487.19

Cite this Page

Triphosphoric acid, P-[[(1S,4R)-4-(2-amino-1,6-dihydro-6-oxo-9H-purin-9-yl)-2-cyclopenten-1-yl]methyl] ester.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=129941-14-6 (retrieved 2024-12-28) (CAS RN: 129941-14-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C11H16N5O11P3/c12-11-14-9-8(10(17)15-11)13-5-16(9)7-2-1-6(3-7)4-25-29(21,22)27-30(23,24)26-28(18,19)20/h1-2,5-7H,3-4H2,(H,21,22)(H,23,24)(H2,18,19,20)(H3,12,14,15,17)/t6-,7+/m1/s1

InChIKey

InChIKey=CQCAEOCIDCCJDQ-RQJHMYQMSA-N

SMILES

O=C1C2=C(N(C=N2)[C@@H]3C[C@H](COP(OP(OP(=O)(O)O)(=O)O)(=O)O)C=C3)NC(N)=N1

Canonical SMILES

O=C1N=C(N)NC2=C1N=CN2C3C=CC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C3

Other Names for this Substance

  • Triphosphoric acid, P-[[(1S,4R)-4-(2-amino-1,6-dihydro-6-oxo-9H-purin-9-yl)-2-cyclopenten-1-yl]methyl] ester
  • Triphosphoric acid, P-[[4-(2-amino-1,6-dihydro-6-oxo-9H-purin-9-yl)-2-cyclopenten-1-yl]methyl] ester, (1S-cis)-
  • (-)-Carbovir 5′-triphosphate
  • (-)-Carbovir triphosphate

Deleted or Replaced CAS Registry Numbers

142276-09-3

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