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Substance Name: Rodaplutin
RN: 108351-49-1
InChIKey: MGPVTRZZQCEQDF-UHFFFAOYSA-N

Note

  • From Nocardioides albus; blasticidin S derivative.

Molecular Weight

  • 565.628
 
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Names and Synonyms

Name of Substance

  • Rodaplutin

Synonym

  • 5'-Hydroxymethylleucylblasticidin S

Systematic Name

  • Hex-2-enopyranuronic acid, 1-(4-amino-5-(hydroxymethyl)-2-oxo-1(2H)-pyrimidinyl)-4-((5-((aminoiminomethyl)methylamino)-3-((2-amino-4-methyl-1-oxopentyl)amino)-1-oxopentyl)amino)-1,2,3,4-tetradeoxy-

Registry Numbers

CAS Registry Number

  • 108351-49-1

System Generated Number

  • 0108351491

Structure Descriptors

InChI

1S/C24H39N9O7/c1-12(2)8-15(25)21(36)29-14(6-7-32(3)23(27)28)9-17(35)30-16-4-5-18(40-19(16)22(37)38)33-10-13(11-34)20(26)31-24(33)39/h4-5,10,12,14-16,18-19,34H,6-9,11,25H2,1-3H3,(H3,27,28)(H,29,36)(H,30,35)(H,37,38)(H2,26,31,39)

InChIKey

MGPVTRZZQCEQDF-UHFFFAOYSA-N

Smiles

C(N(C)C(=N)N)C[C@@H](CC(N[C@@H]1C=C[C@@H](O[C@@H]1C(O)=O)n1cc(CO)c(N)nc1=O)=O)NC(=O)[C@@H](N)CC(C)C