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Substance Name: N-Octanoyldaunorubicin
RN: 62327-70-2
InChIKey: RBOVTPOPAHJDMG-UHFFFAOYSA-N

Molecular Formula

  • C35-H43-N-O11

Molecular Weight

  • 653.7207
 
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Names and Synonyms

Name of Substance

  • N-Octanoyldaunorubicin

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-oxooctyl)amino)-alpha-L-lyxo-hexopyranoxyl)oxy)-, (8S-cis)-

Registry Numbers

CAS Registry Number

  • 62327-70-2

System Generated Number

  • 0062327702

Structure Descriptors

InChI

1S/C35H43NO11/c1-5-6-7-8-9-13-24(38)36-21-14-25(46-17(2)30(21)39)47-23-16-35(44,18(3)37)15-20-27(23)34(43)29-28(32(20)41)31(40)19-11-10-12-22(45-4)26(19)33(29)42/h10-12,17,21,23,25,30,39,41,43-44H,5-9,13-16H2,1-4H3,(H,36,38)

InChIKey

RBOVTPOPAHJDMG-UHFFFAOYSA-N

Smiles

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