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Substance Name: 4-Demethoxy-4'-O-methyldoxorubicin
RN: 87471-33-8
InChIKey: CQXYIKPCIOTYHD-UHFFFAOYSA-N

Molecular Weight

  • 527.5231
 
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Names and Synonyms

Name of Substance

  • 4-Demethoxy-4'-O-methyldoxorubicin

Synonym

  • 4-DM-4'-O-methyldx

Systematic Name

  • 5,12-Naphthacenedione, 7-((3-amino-2,3,6-trideoxy-4-O-methyl-alpha-D-lyxo-hexopyranosyl)oxy)-7,8,9,10-tetrahydro-6,9,11-trihydroxy-9-(hydroxyacetyl)-, (7S-cis)-

Registry Numbers

CAS Registry Number

  • 87471-33-8

System Generated Number

  • 0087471338

Structure Descriptors

InChI

1S/C27H29NO10/c1-11-26(36-2)15(28)7-18(37-11)38-16-9-27(35,17(30)10-29)8-14-19(16)25(34)21-20(24(14)33)22(31)12-5-3-4-6-13(12)23(21)32/h3-6,11,15-16,18,26,29,33-35H,7-10,28H2,1-2H3

InChIKey

CQXYIKPCIOTYHD-UHFFFAOYSA-N

Smiles

CC1C(C(CC(O1)OC2CC(Cc3c2c(c4c(c3O)C(=O)c5ccccc5C4=O)O)(C(=O)CO)O)N)OC