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Substance Name: 3'-C-Methyldaunorubicin
RN: 95087-05-1
InChIKey: FSIMYNFYCYZUON-UHFFFAOYSA-N

Molecular Formula

  • C28-H31-N-O10

Molecular Weight

  • 541.5499
 
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Names and Synonyms

Name of Substance

  • 3'-C-Methyldaunorubicin

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 95087-05-1

System Generated Number

  • 0095087051

Structure Descriptors

InChI

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

InChIKey

FSIMYNFYCYZUON-UHFFFAOYSA-N

Smiles

CC1C(C(CC(O1)OC2CC(Cc3c2c(c4c(c3O)C(=O)c5cccc(c5C4=O)OC)O)(C(=O)C)O)(C)N)O