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Chemistry, part 1

Content language

Contact us: CRM@email.irandoc.ac.ir

Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > carboxamide > peptide > cys-met-thr
organooxygen compound > carboxamide > peptide > cys-met-thr
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > amide > primary amide > carboxamide > peptide > cys-met-thr
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic amino compound > peptide > cys-met-thr
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > organic amino compound > peptide > cys-met-thr

Preferred term

cys-met-thr  

Type

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

Broader concept

charge

  • 0

formula

  • C12H23N3O5S2

inchi

  • InChI=1S/C12H23N3O5S2/c1-6(16)9(12(19)20)15-11(18)8(3-4-22-2)14-10(17)7(13)5-21/h6-9,16,21H,3-5,13H2,1-2H3,(H,14,17)(H,15,18)(H,19,20)/t6-,7+,8+,9+/m1/s1

inchikey

  • SNHRIJBANHPWMO-XGEHTFHBSA-N

mass

  • 353.450

monoisotopicmass

  • 353.10791

smiles

  • S(CC[C@H](NC(=O)[C@@H](N)CS)C(=O)N[C@@H]([C@H](O)C)C(O)=O)C

subset

  • 2_STAR

synonym EXACT

  • (2S,3R)-2-[[(2S)-2-[[(2R)-2-amino-3-sulanylpropanoyl]amino]-4-methylsulanylbutanoyl]amino]-3-hydroxybutanoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:161572

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