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Substance Name: Adenosine 5'-(toluene-4-sulphonate)
RN: 5135-30-8
InChIKey: CAXLRAROZXYOHH-OPJKZUAWSA-N

Molecular Formula

  • C17-H19-N5-O6-S

Molecular Weight

  • 421.432
 
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Names and Synonyms

Synonym

  • EINECS 225-883-1

Systematic Name

  • Adenosine 5'-(toluene-4-sulphonate)

Registry Numbers

CAS Registry Number

  • 5135-30-8

System Generated Number

  • 0005135308

Structure Descriptors

InChI

1S/C17H19N5O6S/c1-9-2-4-10(5-3-9)29(25,26)27-6-11-13(23)14(24)17(28-11)22-8-21-12-15(18)19-7-20-16(12)22/h2-5,7-8,11,13-14,17,23-24H,6H2,1H3,(H2,18,19,20)/t11-,13?,14-,17-/m1/s1

InChIKey

CAXLRAROZXYOHH-OPJKZUAWSA-N

Smiles

n1([C@H]2[C@@H]([C@@H](O)[C@H](O2)COS(c2ccc(cc2)C)(=O)=O)O)c2c(c(N)ncn2)nc1