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Substance Name: Mildiomycin D
RN: 86432-24-8
InChIKey: GVLLATLXQPLOAJ-LGSFDMRSSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H30-N8-O8

Molecular Weight

  • 498.494
 
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Names and Synonyms

Results Name

  • Mildiomycin D

Synonym

  • Mildiomycin D

Systematic Names

  • 2H-Pyran-2-acetic acid, 3,6-dihydro-6-(4-amino-5-(hydroxymethyl)-2-oxo-1(2H)-pyrimidinyl)-3-((2-amino-3-hydroxy-1-oxopropyl)amino)-alpha-(3-((aminoiminomethyl)amino)propyl)-alpha-hydroxy-, (2S-(2-alpha(S*),3-beta(R*),6-alpha))-
  • 2H-Pyran-2-acetic acid, 6-(4-amino-5-(hydroxymethyl)-2-oxo-1(2H)-pyrimidinyl)-3-((2-amino-3-hydroxy-1-oxopropyl)amino)-alpha-(3-((aminoiminomethyl)amino)propyl)-3,6-dihydro-alpha-hydroxy-, (2S-(2alpha(S*),3beta(R*),6alpha))-

Registry Numbers

CAS Registry Number

  • 86432-24-8

System Generated Number

  • 0086432248

Structure Descriptors

InChI

1S/C19H30N8O8/c20-10(8-29)15(30)25-11-2-3-12(27-6-9(7-28)14(21)26-18(27)33)35-13(11)19(34,16(31)32)4-1-5-24-17(22)23/h2-3,6,10-13,28-29,34H,1,4-5,7-8,20H2,(H,25,30)(H,31,32)(H2,21,26,33)(H4,22,23,24)/t10-,11-,12+,13-,19+/m0/s1

InChIKey

GVLLATLXQPLOAJ-LGSFDMRSSA-N

Smiles

c1c(c(nc(=O)n1[C@H]2C=C[C@@H]([C@H](O2)[C@](CCCNC(=N)N)(C(=O)O)O)NC(=O)[C@H](CO)N)N)CO

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 1gm/kg (1000mg/kg)   Agricultural and Biological Chemistry. Vol. 48, Pg. 881, 1984.
mouse LD50 oral > 2500mg/kg (2500mg/kg)   Agricultural and Biological Chemistry. Vol. 48, Pg. 881, 1984.