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Substance Name: Adenosine, 2'-deoxy-N-((1S,2S,3R,4S)-1,2,3,4-tetrahydro-2,3,4-trihydroxybenzo(c)phenanthren-1-yl)-
RN: 107033-09-0
InChIKey: KZCQTFDJSLTNCI-PQRCOPTESA-N

Molecular Formula

  • C28-H27-N5-O6

Molecular Weight

  • 529.55
 
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Names and Synonyms

  • Adenosine, 2'-deoxy-N-((1S,2S,3R,4S)-1,2,3,4-tetrahydro-2,3,4-trihydroxybenzo(c)phenanthren-1-yl)-
  • Adenosine, 2'-deoxy-N-(1,2,3,4-tetrahydro-2,3,4-trihydroxybenzo(c)phenanthren-1-yl)-, (1S-(1alpha,2alpha,3alpha,4beta))-

Registry Numbers

CAS Registry Number

  • 107033-09-0

Other Registry Number

  • 220893-31-2

System Generated Number

  • 0107033090

Structure Descriptors

InChI

1S/C28H27N5O6/c34-10-18-17(35)9-19(39-18)33-12-31-23-27(29-11-30-28(23)33)32-22-21-16(24(36)26(38)25(22)37)8-7-14-6-5-13-3-1-2-4-15(13)20(14)21/h1-8,11-12,17-19,22,24-26,34-38H,9-10H2,(H,29,30,32)/t17-,18+,19+,22-,24-,25-,26+/m0/s1

InChIKey

KZCQTFDJSLTNCI-PQRCOPTESA-N

Smiles

n1cn([C@H]2C[C@H](O)[C@H](CO)O2)c2c1c(N[C@H]1c3c(ccc4c3c3c(cc4)cccc3)[C@@H]([C@H]([C@H]1O)O)O)ncn2