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Substance Name: Setomimycin
RN: 69431-87-4
InChIKey: BIEJOJJMQZEKED-UHFFFAOYSA-N

Note

  • Isolated from culture broth of Streptomyces pseudovenezuelae.

Classification Codes

  • Drug / Therapeutic Agent
  • Natural Product

Molecular Formula

  • C34-H28-O9

Molecular Weight

  • 580.586
 
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Names and Synonyms

Name of Substance

  • Setomimycin

Synonyms

  • AM-2947
  • Antibiotic A 39183B
  • BRN 5202658
  • Setomimycin

Systematic Names

  • (9,9'-Bianthracene)-4,4'(1H,1'H)-dione, 1,1'-diacetyl-2,3-dihydro-2,5,5',10,10'-pentahydroxy-2,2'-dimethyl-
  • (9,9'-Bianthracene)-4,4'(1H,1'H)-dione, 2,3-dihydro-1,1'-diacetyl-2,2'-dimethyl-2,5,5',10,10'-pentahydroxy-

Registry Numbers

CAS Registry Number

  • 69431-87-4

System Generated Number

  • 0069431874

Structure Descriptors

InChI

1S/C34H28O9/c1-13-11-20(39)27-29(22(13)14(2)35)25(16-7-5-9-18(37)23(16)32(27)41)26-17-8-6-10-19(38)24(17)33(42)28-21(40)12-34(4,43)31(15(3)36)30(26)28/h5-11,22,31,37-38,41-43H,12H2,1-4H3

InChIKey

BIEJOJJMQZEKED-UHFFFAOYSA-N

Smiles

C1[C@@]([C@@H](c2c(c3cccc(c3c(c2C1=O)O)O)c1c2cccc(c2c(c2C(C=C([C@@H](c12)C(=O)C)C)=O)O)O)C(=O)C)(C)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 100mg/kg (100mg/kg)   "CRC Handbook of Antibiotic Compounds," Vols.1- , Berdy, J., Boca Raton, FL, CRC Press, 1980Vol. 11(2), Pg. 298, 1985.
mouse LD50 intravenous 60mg/kg (60mg/kg)   Journal of Antibiotics. Vol. 31, Pg. 1091, 1978.