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Chemistry, part 1

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > amino-acid derivative > proline derivative > bu-2545

Preferred term

bu-2545  

Type

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

Broader concept

charge

  • 0

formula

  • C16H30N2O6S

inchi

  • InChI=1S/C16H30N2O6S/c1-8(23-3)10(17-15(22)9-6-5-7-18(9)2)14-12(20)11(19)13(21)16(24-14)25-4/h8-14,16,19-21H,5-7H2,1-4H3,(H,17,22)

inchikey

  • WVXCVWNSJUNIRQ-UHFFFAOYSA-N

mass

  • 378.480

monoisotopicmass

  • 378.18246

smiles

  • S(C1OC(C(O)C(C1O)O)C(NC(=O)C2N(CCC2)C)C(OC)C)C

subset

  • 2_STAR

synonym EXACT

  • N-[2-methoxy-1-(3,4,5-trihydroxy-6-methylsulanyloxan-2-yl)propyl]-1-methylpyrrolidine-2-carboxamide

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:223557

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