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Substance Name: 5'-Thymidylic acid, mono(4-nitrophenyl) ester, monoammonium salt
RN: 83918-61-0
InChIKey: UHFBCZJBOZBWER-SOIKFHLCSA-N

Molecular Formula

  • C16-H18-N3-O10-P.H3-N

Molecular Weight

  • 460.3339
 
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Names and Synonyms

Synonym

  • EINECS 281-296-0

Systematic Name

  • 5'-Thymidylic acid, mono(4-nitrophenyl) ester, monoammonium salt

Registry Numbers

CAS Registry Number

  • 83918-61-0

System Generated Number

  • 0083918610

Molecular Formulas

Molecular Formula

  • C16-H18-N3-O10-P.H3-N

Molecular Formula Fragments

  • C16-H18-N3-O10-P
  • COMPONENT
  • H3-N

Structure Descriptors

InChI

1S/C16H18N3O10P.H3N/c1-9-7-18(16(22)17-15(9)21)14-6-12(20)13(28-14)8-27-30(25,26)29-11-4-2-10(3-5-11)19(23)24;/h2-5,7,12-14,20H,6,8H2,1H3,(H,25,26)(H,17,21,22);1H3/t12-,13+,14+;/m0./s1

InChIKey

UHFBCZJBOZBWER-SOIKFHLCSA-N

Smiles

Cc1cn(c(=O)[nH]c1=O)[C@H]2C[C@@H]([C@H](O2)COP(=O)([O-])Oc3ccc(cc3)[N+](=O)[O-])O.[NH4+]