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Substance Name: Validamycin C
RN: 12650-70-3
InChIKey: IUZLKGXGTJOZDV-UHFFFAOYSA-N

Classification Codes

  • Drug / Therapeutic Agent
  • Natural Product

Molecular Formula

  • C26-H45-N-O18

Molecular Weight

  • 659.63
 
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Names and Synonyms

Synonym

  • BRN 4835203

Systematic Name

  • Validamycin C

Registry Numbers

CAS Registry Number

  • 12650-70-3

System Generated Number

  • 0012650703

Structure Descriptors

InChI

1S/C26H45NO18/c28-3-7-1-9(15(33)21(39)24(7)45-26-23(41)20(38)17(35)12(5-30)44-26)27-10-2-8(13(31)18(36)14(10)32)6-42-25-22(40)19(37)16(34)11(4-29)43-25/h2,7,9-41H,1,3-6H2

InChIKey

IUZLKGXGTJOZDV-UHFFFAOYSA-N

Smiles

O1[C@@H]([C@@H]([C@@H]([C@@H]([C@@H]1O[C@@H]1[C@@H](O)[C@@H]([C@@H](N[C@@H]2C=C(CO[C@@H]3[C@@H]([C@@H]([C@@H]([C@@H](CO)O3)O)O)O)[C@@H](O)[C@@H](O)[C@@H]2O)C[C@@H]1CO)O)O)O)O)CO

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous > 2gm/kg (2000mg/kg)   United States Patent Document. Vol. #4089947,
mouse LD50 oral 2gm/kg (2000mg/kg)   "CRC Handbook of Antibiotic Compounds," Vols.1- , Berdy, J., Boca Raton, FL, CRC Press, 1980Vol. 1, Pg. 230, 1981.