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Chemistry, part 1

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Concept information

... > organooxygen compound > ester > carboxylic ester > amino-acid ester > alpha-amino acid ester > violaceimide a
... > organooxygen compound > carbonyl compound > carboxylic ester > amino-acid ester > alpha-amino acid ester > violaceimide a
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > amino-acid derivative > amino-acid ester > alpha-amino acid ester > violaceimide a

Preferred term

violaceimide a  

Type

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

Broader concept

charge

  • 0

formula

  • C12H17NO7S

inchi

  • InChI=1S/C12H17NO7S/c1-6-3-9(15)13(10(6)16)7(12(19)20-2)4-21-5-8(14)11(17)18/h6-8,14H,3-5H2,1-2H3,(H,17,18)/t6-,7-,8+/m1/s1

inchikey

  • KMOGJXSUBZHITP-PRJMDXOYSA-N

mass

  • 319.330

monoisotopicmass

  • 319.07257

smiles

  • S(C[C@H](O)C(=O)O)C[C@@H](N1C(=O)[C@H](C)CC1=O)C(=O)OC

subset

  • 2_STAR

synonym EXACT

  • (2R)-2-hydroxy-3-[(2S)-3-methoxy-2-[(3R)-3-methyl-2,5-dioxopyrrolidin-1-yl]-3-oxopropyl]sulanylpropanoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:217954

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