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Substance Name: 7-Deoxy-13-dihydroadriamycinone
RN: 116455-20-0
InChIKey: IGJIPNOEJDYNRR-UHFFFAOYSA-N

Note

  • A metabolite of epidoxorubicin.

Molecular Formula

  • C21-H20-O8

Molecular Weight

  • 400.381
 
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Names and Synonyms

Name of Substance

  • 7-Deoxy-13-dihydroadriamycinone

Synonyms

  • 7-Deoxydoxorubicinolone
  • 8-(1,2-Dihydroxyethyl)-7,8,9,10-tetrahydro-6,8,11-trihydroxy-1-methoxy-5,12-naphthacenedione
  • Aglycone C

Systematic Name

  • 5,12-Naphthacenedione, 8-(1,2-dihydroxyethyl)-7,8,9,10-tetrahydro-6,8,11-trihydroxy-1-methoxy-

Registry Numbers

CAS Registry Number

  • 116455-20-0

System Generated Number

  • 0116455200

Structure Descriptors

InChI

1S/C21H20O8/c1-29-12-4-2-3-10-14(12)20(27)16-15(18(10)25)19(26)11-7-21(28,13(23)8-22)6-5-9(11)17(16)24/h2-4,13,22-24,26,28H,5-8H2,1H3

InChIKey

IGJIPNOEJDYNRR-UHFFFAOYSA-N

Smiles

COc1cccc2c1C(=O)c3c(c(c4c(c3O)CCC(C4)(C(CO)O)O)O)C2=O