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Substance Name: Triocacarcinone A
RN: 81552-35-4
InChIKey: CPBAGBXYUGCFGT-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C25-H26-O12

Molecular Weight

  • 518.4684
 
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Names and Synonyms

Synonyms

  • Antibiotic DC 45 A(sub 2)
  • DC-45 A(sub 2)
  • Trioxacarcin A(sub 2)

Systematic Name

  • Triocacarcinone A

Registry Numbers

CAS Registry Number

  • 81552-35-4

System Generated Number

  • 0081552354

Structure Descriptors

InChI

1S/C25H26O12/c1-8-5-9-13(17(29)15-14(18(9)31-2)10(26)6-11(27)16(15)28)19-12(8)20-21-24(30,35-19)23(7-34-23)25(36-20,37-21)22(32-3)33-4/h5,10-11,20-22,26-27,29-30H,6-7H2,1-4H3

InChIKey

CPBAGBXYUGCFGT-UHFFFAOYSA-N

Smiles

Cc1cc2c(c(c3c(c2OC)C(CC(C3=O)O)O)O)c4c1C5C6C(O4)(C7(CO7)C(O5)(O6)C(OC)OC)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 5800ug/kg (5.8mg/kg)   Japanese Kokai Tokyo Koho Patents. Vol. #83-99415,
mouse LD50 intravenous 14mg/kg (14mg/kg)   Japanese Kokai Tokyo Koho Patents. Vol. #83-99415,