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Substance Name: N-Dodecanoyl daunorubicin
RN: 62327-71-3
InChIKey: XJXFAWUIKCXQAL-UHFFFAOYSA-N

Molecular Formula

  • C39-H51-N-O11

Molecular Weight

  • 709.8279
 
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Names and Synonyms

Results Name

  • N-Dodecanoyl daunorubicin

Synonyms

  • (8S-cis)-8-Acetyl-7,8,9,10-tetrahydro-6,8,11-trihydroxy-1-methoxy-10-((2,3,6-trideoxy-3-((1-oxododecyl)amino)-alpha-L-lyxo-hexopyranosyl)oxy)-5,12-naphthacenedione
  • N-Dodecanoyl daunorubicin

Systematic Name

  • 5,12-Naphthacenedione, 8-acetyl-7,8,9,10-tetrahydro-6,8,11-trihydroxy-1-methoxy-10-((2,3,6-trideoxy-3-((1-oxododecyl)amino)-alpha-L-lyxo-hexopyranosyl)oxy)-, (8S-cis)-

Registry Numbers

CAS Registry Number

  • 62327-71-3

System Generated Number

  • 0062327713

Structure Descriptors

InChI

1S/C39H51NO11/c1-5-6-7-8-9-10-11-12-13-17-28(42)40-25-18-29(50-21(2)34(25)43)51-27-20-39(48,22(3)41)19-24-31(27)38(47)33-32(36(24)45)35(44)23-15-14-16-26(49-4)30(23)37(33)46/h14-16,21,25,27,29,34,43,45,47-48H,5-13,17-20H2,1-4H3,(H,40,42)

InChIKey

XJXFAWUIKCXQAL-UHFFFAOYSA-N

Smiles

CCCCCCCCCCCC(=O)NC1CC(OC2CC(O)(Cc3c(O)c4C(=O)c5cccc(OC)c5C(=O)c4c(O)c23)C(=O)C)OC(C)C1O