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Substance Name: Daunorubicin 13-tert-butoxycarbonylhydrazone
RN: 81361-01-5
InChIKey: QGJBJELLCRBYNJ-PBEOLHQGSA-N

Molecular Formula

  • C32-H39-N3-O11

Molecular Weight

  • 641.6701
 
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Names and Synonyms

Name of Substance

  • Daunorubicin 13-tert-butoxycarbonylhydrazone

Synonyms

  • RTBCH
  • Rubomycin 13-tert-butoxycarbonylhydrazone

Systematic Name

  • Hydrazinecarboxylic acid, (1-(4-((3-amino-2,3,6-trideoxy-alpha-L-lyxo-hexopyranosyl)oxy)-1,2,3,4,6,11-hexahydro-2,5,12-trihydroxy-7-methoxy-6,11-dioxo-2-naphthacenyl)ethylidene)-, 1,1-dimethylethyl ester, (2S-cis)-

Registry Numbers

CAS Registry Number

  • 81361-01-5

System Generated Number

  • 0081361015

Structure Descriptors

InChI

1S/C32H39N3O11/c1-13-25(36)17(33)10-20(44-13)45-19-12-32(42,14(2)34-35-30(41)46-31(3,4)5)11-16-22(19)29(40)24-23(27(16)38)26(37)15-8-7-9-18(43-6)21(15)28(24)39/h7-9,13,17,19-20,25,36,38,40,42H,10-12,33H2,1-6H3,(H,35,41)/b34-14-

InChIKey

QGJBJELLCRBYNJ-PBEOLHQGSA-N

Smiles

COc1cccc2C(=O)c3c(O)c4CC(O)(CC(OC5CC(N)C(O)C(C)O5)c4c(O)c3C(=O)c12)\C(=N/NC(=O)OC(C)(C)C)\C