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Substance Name: N-(Carbamoylmethyl)daunorubicin
RN: 103620-82-2
InChIKey: WKCYAQRUHIRHRE-UHFFFAOYSA-N

Classification Code

  • Mutation Data

Molecular Formula

  • C29-H32-N2-O11

Molecular Weight

  • 584.5748
 
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Names and Synonyms

Results Name

  • N-(Carbamoylmethyl)daunorubicin

Synonyms

  • BRN 6049733
  • N-(Carbamoylmethyl)daunorubicin

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 103620-82-2

System Generated Number

  • 0103620822

Structure Descriptors

InChI

1S/C29H32N2O11/c1-11-24(34)15(31-10-18(30)33)7-19(41-11)42-17-9-29(39,12(2)32)8-14-21(17)28(38)23-22(26(14)36)25(35)13-5-4-6-16(40-3)20(13)27(23)37/h4-6,11,15,17,19,24,31,34,36,38-39H,7-10H2,1-3H3,(H2,30,33)

InChIKey

WKCYAQRUHIRHRE-UHFFFAOYSA-N

Smiles

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