Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 5-(Dansylglycyl-6-aminohexanoylaminoprop-1-enyl)-2'-deoxyuridine 5'-triphosphate
RN: 109921-29-1
InChIKey: XLQIJNPDYBWUAP-UNPHZPOWSA-R

Molecular Formula

  • C32-H45-N6-O18-P3-S.4H3-N

Molecular Weight

  • 998.874
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Name of Substance

  • 5-(Dansylglycyl-6-aminohexanoylaminoprop-1-enyl)-2'-deoxyuridine 5'-triphosphate

Synonym

  • 5-Dgapdt

Systematic Name

  • Uridine 5'-(tetrahydrogen triphosphate), 2'-deoxy-5-(3-((6-(((((5-(dimethylamino)-1-naphthalenyl)sulfonyl)amino)acetyl)amino)-1-oxohexyl)amino)-1-propenyl)-, tetraammonium salt

Registry Numbers

CAS Registry Number

  • 109921-29-1

System Generated Number

  • 0109921291

Molecular Formulas

Molecular Formula

  • C32-H45-N6-O18-P3-S.4H3-N

Molecular Formula Fragments

  • C32-H45-N6-O18-P3-S
  • COMPONENT
  • H3-N

Structure Descriptors

InChI

1S/C32H45N6O18P3S.4H3N/c1-36(2)23-11-5-10-22-21(23)9-6-12-26(22)60(51,52)27(34)13-3-4-14-28(40)37(29(41)17-33)15-7-8-20-18-38(32(43)35-31(20)42)30-16-24(39)25(54-30)19-53-58(47,48)56-59(49,50)55-57(44,45)46;;;;/h5-12,18,24-25,27,30,39H,3-4,13-17,19,33-34H2,1-2H3,(H,47,48)(H,49,50)(H,35,42,43)(H2,44,45,46);4*1H3/p+4/b8-7+;;;;/t24-,25+,27?,30+;;;;/m0..../s1

InChIKey

XLQIJNPDYBWUAP-UNPHZPOWSA-R

Smiles

C([C@@H]1[C@@H](O)C[C@@H](O1)n1c(=O)[nH]c(=O)c(c1)\C=C\CN(C(CCCC[C@@H](N)S(c1cccc2c(N(C)C)cccc12)(=O)=O)=O)C(CN)=O)O[P@@](=O)(O)O[P@@](=O)(O)OP(=O)(O)O.[NH4+].[NH4+].[NH4+].[NH4+]