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Chemistry, part 1

Content language

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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 > carboxamide > lactam > beta-lactam > beta-lactam antibiotic > carbapenems > mk826
... > organooxygen compound > carboxamide > lactam > beta-lactam > beta-lactam antibiotic > carbapenems > mk826
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > amide > primary amide > carboxamide > lactam > beta-lactam > beta-lactam antibiotic > carbapenems > mk826
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > organonitrogen heterocyclic compound > lactam > beta-lactam > beta-lactam antibiotic > carbapenems > mk826
... > organic heterocyclic compound > organonitrogen heterocyclic compound > lactam > beta-lactam > beta-lactam antibiotic > carbapenems > mk826
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > organonitrogen heterocyclic compound > carbapenems > mk826
organic heterocyclic compound > organonitrogen heterocyclic compound > carbapenems > mk826
organic heterocyclic compound > organic heteropolycyclic compound > organic heterobicyclic compound > carbapenems > mk826

Preferred term

mk826  

Type

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

Broader concept

charge

  • 0

formula

  • C21H23N3O7S2

inchi

  • InChI=1S/C21H23N3O7S2/c1-8-14-13(9(2)25)18(27)24(14)15(20(30)31)16(8)33-21-23-12(7-32-21)17(26)22-11-5-3-4-10(6-11)19(28)29/h3-6,8-9,12-14,21,23,25H,7H2,1-2H3,(H,22,26)(H,28,29)(H,30,31)

inchikey

  • WQQHQJCEAFGLEA-UHFFFAOYSA-N

mass

  • 493.556

monoisotopicmass

  • 493.09774

smiles

  • CC(O)C1C2C(C)C(SC3NC(CS3)C(=O)Nc3cccc(c3)C(O)=O)=C(N2C1=O)C(O)=O

subset

  • 2_STAR

synonym EXACT

  • MK826

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:29621

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