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Substance Name: N,N-Diethyladriamycin hydrochloride
RN: 70844-09-6
InChIKey: GDIORRHLBKYQCZ-UHFFFAOYSA-N

Classification Code

  • Mutation Data

Molecular Formula

  • C31-H37-N-O11.Cl-H

Molecular Weight

  • 636.09
 
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Names and Synonyms

Results Name

  • N,N-Diethyladriamycin hydrochloride

Synonym

  • N,N-Diethyladriamycin hydrochloride

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 70844-09-6

System Generated Number

  • 0070844096

Molecular Formulas

Molecular Formula

  • C31-H37-N-O11.Cl-H

Molecular Formula Fragments

  • C31-H37-N-O11
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C31H37NO11.ClH/c1-5-32(6-2)17-10-21(42-14(3)26(17)35)43-19-12-31(40,20(34)13-33)11-16-23(19)30(39)25-24(28(16)37)27(36)15-8-7-9-18(41-4)22(15)29(25)38;/h7-9,14,17,19,21,26,33,35,37,39-40H,5-6,10-13H2,1-4H3;1H

InChIKey

GDIORRHLBKYQCZ-UHFFFAOYSA-N

Smiles

Cl.C1[C@@H]([C@@H]([C@@H](C)O[C@@H]1O[C@@H]1c2c(O)c3C(=O)c4c(cccc4C(=O)c3c(O)c2C[C@@](C1)(O)C(CO)=O)OC)O)N(CC)CC