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Substance Name: Leucyl-leucyldaunorubicin monohydrochloride
RN: 74853-78-4
InChIKey: BMHPCCYZJRWRDE-UHFFFAOYSA-N

Molecular Formula

  • C39-H51-N3-O12.Cl-H

Molecular Weight

  • 790.302
 
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Names and Synonyms

Results Name

  • Leucyl-leucyldaunorubicin monohydrochloride

Synonyms

  • 8-Acetyl-7,8,9,10-tetrahydro-6,8,11-trihydroxy-1-methoxy-10-((2,3,6-trideoxy-3-((N-L-leucyl-L-leucyl)amino)-alpha-L-lyxo-hexopyranosyl)oxy)-5,12-naphthacenedione monohydrochloride, (8S-cis)-
  • Leucyl-leucyldaunorubicin HCl
  • Leucyl-leucyldaunorubicin monohydrochloride

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 74853-78-4

System Generated Number

  • 0074853784

Molecular Formulas

Molecular Formula

  • C39-H51-N3-O12.Cl-H

Molecular Formula Fragments

  • C39-H51-N3-O12
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C39H51N3O12.ClH/c1-16(2)11-22(40)37(49)42-24(12-17(3)4)38(50)41-23-13-27(53-18(5)32(23)44)54-26-15-39(51,19(6)43)14-21-29(26)36(48)31-30(34(21)46)33(45)20-9-8-10-25(52-7)28(20)35(31)47;/h8-10,16-18,22-24,26-27,32,44,46,48,51H,11-15,40H2,1-7H3,(H,41,50)(H,42,49);1H

InChIKey

BMHPCCYZJRWRDE-UHFFFAOYSA-N

Smiles

C1[C@@H](O[C@@H]2c3c(O)c4C(=O)c5c(cccc5C(=O)c4c(O)c3C[C@@](C(C)=O)(C2)O)OC)O[C@@H]([C@@H](O)[C@@H]1NC([C@@H](CC(C)C)NC([C@@H](CC(C)C)N)=O)=O)C.Cl