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Substance Name: 14-Salicyloylcarubicin
RN: 116907-26-7
InChIKey: AJAHDRMPRTTZMX-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C33-H31-N-O13

Molecular Weight

  • 649.602
 
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Names and Synonyms

Name of Substance

  • 14-Salicyloylcarubicin

Synonyms

  • 14-Salicyloylcarubicin
  • 14-Salicyloyloxycarminomycin

Systematic Name

  • Benzoic acid, 2-hydroxy-, 2-(4-((3-amino-2,3,6-trideoxy-alpha-L-lyxo-hexopyranosyl)oxy)-1,2,3,4,6,11-hexahydro-2,5,7,12-tetrahydroxy-6,11-dioxo-2-naphthacenyl)-2-oxoethyl ester, (2S-cis)-

Registry Numbers

CAS Registry Number

  • 116907-26-7

System Generated Number

  • 0116907267

Structure Descriptors

InChI

1S/C33H31NO13/c1-13-27(38)17(34)9-22(46-13)47-20-11-33(44,21(37)12-45-32(43)14-5-2-3-7-18(14)35)10-16-24(20)31(42)26-25(29(16)40)28(39)15-6-4-8-19(36)23(15)30(26)41/h2-8,13,17,20,22,27,35-36,38,40,42,44H,9-12,34H2,1H3

InChIKey

AJAHDRMPRTTZMX-UHFFFAOYSA-N

Smiles

O1[C@@H](C[C@@H]([C@@H]([C@@H]1C)O)N)O[C@@H]1c2c(c3C(=O)c4c(cccc4C(=O)c3c(c2C[C@@](C1)(O)C(COC(c1ccccc1O)=O)=O)O)O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 6800ug/kg (6.8mg/kg)   Antibiotiki i Khimioterapiya. Antibiotics and Chemotherapy. Vol. 35(2), Pg. 24, 1990.