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Substance Name: O(4)-Ethylthymidine 5'-triphosphate
RN: 96027-03-1
InChIKey: BKPIEXSGCJRDDJ-IVZWLZJFSA-N

Molecular Formula

  • C12-H12-N2-O14-P3

Molecular Weight

  • 510.2199
 
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Names and Synonyms

Name of Substance

  • O(4)-Ethylthymidine 5'-triphosphate

Synonym

  • 4-ET-Ttp

Systematic Name

  • 2(1H)-Pyrimidinone, 1-(2-deoxy-5-O-(hydroxy((hydroxy(phosphonooxy)phosphinyl)oxy)phosphinyl)-beta-D-erythro-pentofuranosyl)-4-ethoxy-5-methyl-

Registry Numbers

CAS Registry Number

  • 96027-03-1

System Generated Number

  • 0096027031

Structure Descriptors

InChI

1S/C12H21N2O14P3/c1-3-24-11-7(2)5-14(12(16)13-11)10-4-8(15)9(26-10)6-25-30(20,21)28-31(22,23)27-29(17,18)19/h5,8-10,15H,3-4,6H2,1-2H3,(H,20,21)(H,22,23)(H2,17,18,19)/t8-,9+,10+/m0/s1

InChIKey

BKPIEXSGCJRDDJ-IVZWLZJFSA-N

Smiles

CCOc1c(cn(c(=O)n1)[C@H]2C[C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O)C