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Substance Name: Aclacinomycin Y
RN: 66789-14-8
InChIKey: ADCDIHNCUQOKFP-UHFFFAOYSA-N

Classification Codes

  • Drug / Therapeutic Agent
  • Mutation Data

Molecular Formula

  • C42-H51-N-O15

Molecular Weight

  • 809.857
 
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Names and Synonyms

Results Name

  • Aclacinomycin Y

Synonyms

  • Aclacinomycin Y
  • Aclacinomycin Y1
  • MA 144 Y

Systematic Name

  • 1-Naphthacenecarboxylic acid, 1,2,3,4,6,11-hexahydro-6,11-dioxo-2-ethyl-4-((4-O-(2,6-dideoxy-4-O-((2R-trans)-5,6-dihydro-6-methyl-5-oxo-2H-pyran-2-yl)alpha-L-lyxo-hexopyranosyl)-3-dimethylamino-2,3,6-trideoxy-alpha-L-lyxo-hexopyranosyl)oxy)-2,5,7-trihydroxy-, methyl ester, (1R-(1-alpha,2-beta,4-beta))-

Registry Numbers

CAS Registry Number

  • 66789-14-8

Other Registry Number

  • 67298-12-8

System Generated Number

  • 0066789148

Structure Descriptors

InChI

1S/C42H51NO15/c1-8-42(51)17-28(33-22(35(42)41(50)52-7)14-23-34(38(33)49)37(48)32-21(36(23)47)10-9-11-26(32)45)56-30-15-24(43(5)6)39(19(3)54-30)58-31-16-27(46)40(20(4)55-31)57-29-13-12-25(44)18(2)53-29/h9-14,18-20,24,27-31,35,39-40,45-46,49,51H,8,15-17H2,1-7H3

InChIKey

ADCDIHNCUQOKFP-UHFFFAOYSA-N

Smiles

O1[C@@H](C=CC([C@@H]1C)=O)O[C@@H]1[C@@H](C[C@@H](O[C@@H]1C)O[C@@H]1[C@@H](C[C@@H](O[C@@H]1C)O[C@@H]1c2c(c3C(=O)c4c(O)cccc4C(=O)c3cc2[C@@H]([C@@](C1)(O)CC)C(=O)OC)O)N(C)C)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 40mg/kg (40mg/kg)   Journal of Antibiotics. Vol. 33, Pg. 80-64, 1980.