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Substance Name: 2'-C-Methyldaunomycin
RN: 127860-18-8
InChIKey: LQZCEOUZGVKWCU-UHFFFAOYSA-N

Molecular Formula

  • C28-H31-N-O10.Cl-H

Molecular Weight

  • 578.0108
 
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Names and Synonyms

Name of Substance

  • 2'-C-Methyldaunomycin

Synonyms

  • (8S-cis)-8-Acetyl-10-((3-amino-2,3,6-dideoxy-alpha-L-talopyranosyl)oxy)-7,8,9,10-tetrahydro-6,8,11-trihydroxy-1-methoxy-5,12-naphthacenedione hydrochloride
  • 2'-C-Methyldaunorubicin
  • 2'-Methyldaunomycin
  • 8-Acetyl-10-((3-amino-2,3,6-dideoxy-alpha-L-talopyranosyl)oxy)-7,8,9,10-tetrahydro-6,8,11-trihydroxy-1-methoxy-5,12-naphthacenedione hydrochloride, (8S-cis)-

Systematic Name

  • 5,12-Naphthacenedione, 8-acetyl-10-((3-amino-2,3,6-dideoxy-alpha-L-talopyranosyl)oxy)-7,8,9,10-tetrahydro-6,8,11-trihydroxy-1-methoxy-, hydrochloride, (8S-cis)-

Registry Numbers

CAS Registry Number

  • 127860-18-8

System Generated Number

  • 0127860188

Molecular Formulas

Molecular Formula

  • C28-H31-N-O10.Cl-H

Molecular Formula Fragments

  • C28-H31-N-O10
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C28H31NO10.ClH/c1-10-21(29)22(31)11(2)38-27(10)39-16-9-28(36,12(3)30)8-14-18(16)26(35)20-19(24(14)33)23(32)13-6-5-7-15(37-4)17(13)25(20)34;/h5-7,10-11,16,21-22,27,31,33,35-36H,8-9,29H2,1-4H3;1H

InChIKey

LQZCEOUZGVKWCU-UHFFFAOYSA-N

Smiles

CC1C(C(C(OC1OC2CC(Cc3c2c(c4c(c3O)C(=O)c5cccc(c5C4=O)OC)O)(C(=O)C)O)C)O)N.Cl