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Substance Name: NSC 246105
RN: 58161-66-3
InChIKey: AOTOTQJQLKTBST-BUUAQDLPSA-N

Molecular Formula

  • C35-H44-N2-O11.Cl-H

Molecular Weight

  • 705.196
 
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Names and Synonyms

Results Name

  • NSC 246105

Synonyms

  • 8-Acetyl-7,8,9,10-tetrahydro-6,8,11-trihydroxy-1-methoxy-10-((2,3,6-trideoxy-3-(((dipropylamino)acetyl)amino)-alpha-L-lyxo-hexopyranosyl)oxy)-5,12-naphthacenedione monohydrochloride, (8S-cis)-
  • NSC 246105

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 58161-66-3

System Generated Number

  • 0058161663

Molecular Formulas

Molecular Formula

  • C35-H44-N2-O11.Cl-H

Molecular Formula Fragments

  • C35-H44-N2-O11
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C35H44N2O11.ClH/c1-6-11-37(12-7-2)16-24(39)36-21-13-25(47-17(3)30(21)40)48-23-15-35(45,18(4)38)14-20-27(23)34(44)29-28(32(20)42)31(41)19-9-8-10-22(46-5)26(19)33(29)43;/h8-10,17,21,23,25,30,40,42,44-45H,6-7,11-16H2,1-5H3,(H,36,39);1H/t17-,21-,23-,25-,30+,35-;/m0./s1

InChIKey

AOTOTQJQLKTBST-BUUAQDLPSA-N

Smiles

Cl.C([C@]1(C[C@H](O[C@@H]2O[C@H]([C@H]([C@H](NC(CN(CCC)CCC)=O)C2)O)C)c2c(O)c3c(C(c4c(c(ccc4)OC)C3=O)=O)c(c2C1)O)O)(C)=O