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Concept information

Preferred term

sparoxomycin a1  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • C13H19N3O6S2

inchi

  • InChI=1S/C13H19N3O6S2/c1-8-10(12(19)16-13(20)14-8)3-4-11(18)15-9(5-17)6-24(22)7-23(2)21/h3-4,9,17H,5-7H2,1-2H3,(H,15,18)(H2,14,16,19,20)/b4-3+/t9-,23+,24-/m0/s1

inchikey

  • ZIMCIWWBWLSQCN-SLXIMNNBSA-N

mass

  • 377.430

monoisotopicmass

  • 377.07153

smiles

  • [S@@](=O)(C[S@](=O)C)C[C@@H](NC(=O)/C=C/C=1C(=O)NC(=O)NC1C)CO

subset

  • 2_STAR

synonym EXACT

  • (E)-N-[(2S)-1-hydroxy-3-[(R)-[(S)-methylsulinyl]methylsulinyl]propan-2-yl]-3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)prop-2-enamide

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:200501

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