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Substance Name: N-Methyldaunomycin
RN: 67508-86-5
InChIKey: NQDLNSRKFPKZCV-RWNSZTQCSA-N

Classification Code

  • Mutation Data

Molecular Formula

  • C28-H31-N-O10

Molecular Weight

  • 541.5499
 
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Names and Synonyms

Results Name

  • N-Methyldaunomycin

Synonym

  • N-Methyldaunomycin

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 67508-86-5

System Generated Number

  • 0067508865

Structure Descriptors

InChI

1S/C28H31NO10/c1-11-23(31)15(29-3)8-18(38-11)39-17-10-28(36,12(2)30)9-14-20(17)27(35)22-21(25(14)33)24(32)13-6-5-7-16(37-4)19(13)26(22)34/h5-7,11,15,17-18,23,29,31,33,35-36H,8-10H2,1-4H3/t11-,15-,17-,18-,23+,28-/m0/s1

InChIKey

NQDLNSRKFPKZCV-RWNSZTQCSA-N

Smiles

C[C@H]1[C@H]([C@H](C[C@@H](O1)O[C@H]2C[C@@](Cc3c2c(c4c(c3O)C(=O)c5cccc(c5C4=O)OC)O)(C(=O)C)O)NC)O