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Substance Name: Thiazole-4-carboxamide adenine dinucleotide
RN: 83285-83-0
InChIKey: INQLNSVYIFCUML-QZTLEVGFSA-N

Classification Code

  • Enzyme Inhibitors

Molecular Formula

  • C19-H25-N7-O14-P2-S

Molecular Weight

  • 669.4555
 
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Names and Synonyms

Name of Substance

  • Thiazole-4-carboxamide adenine dinucleotide

Synonyms

  • NSC 358285
  • TCAD
  • Tiazofurin adenine dinucleotide

Systematic Name

  • Adenosine 5'-(trihydrogen diphosphate), 5'-5'-ester with 2-beta-D-ribofuranosyl-4-thiazolecarboxamide

Registry Numbers

CAS Registry Number

  • 83285-83-0

System Generated Number

  • 0083285830

Structure Descriptors

InChI

1S/C19H25N7O14P2S/c20-15-9-17(23-4-22-15)26(5-24-9)19-13(30)11(28)8(39-19)2-37-42(34,35)40-41(32,33)36-1-7-10(27)12(29)14(38-7)18-25-6(3-43-18)16(21)31/h3-5,7-8,10-14,19,27-30H,1-2H2,(H2,21,31)(H,32,33)(H,34,35)(H2,20,22,23)/t7-,8-,10-,11-,12-,13-,14-,19-/m1/s1

InChIKey

INQLNSVYIFCUML-QZTLEVGFSA-N

Smiles

c1c(nc(s1)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)n4cnc5c4ncnc5N)O)O)O)O)C(=O)N