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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 > carboxamide > peptide > 2-amino-4-(/{1-[(carboxymethyl)-c-hydroxycarbonimidoyl]-2-/{[1-(2-hydroxy-4-methoxyphenyl)-3-oxopropyl]sulfanyl/}ethyl/}-c-hydroxycarbonimidoyl)butanoic acid
organooxygen compound > carboxamide > peptide > 2-amino-4-(/{1-[(carboxymethyl)-c-hydroxycarbonimidoyl]-2-/{[1-(2-hydroxy-4-methoxyphenyl)-3-oxopropyl]sulfanyl/}ethyl/}-c-hydroxycarbonimidoyl)butanoic acid
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > amide > primary amide > carboxamide > peptide > 2-amino-4-(/{1-[(carboxymethyl)-c-hydroxycarbonimidoyl]-2-/{[1-(2-hydroxy-4-methoxyphenyl)-3-oxopropyl]sulfanyl/}ethyl/}-c-hydroxycarbonimidoyl)butanoic acid
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic amino compound > peptide > 2-amino-4-(/{1-[(carboxymethyl)-c-hydroxycarbonimidoyl]-2-/{[1-(2-hydroxy-4-methoxyphenyl)-3-oxopropyl]sulfanyl/}ethyl/}-c-hydroxycarbonimidoyl)butanoic acid
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > organic amino compound > peptide > 2-amino-4-(/{1-[(carboxymethyl)-c-hydroxycarbonimidoyl]-2-/{[1-(2-hydroxy-4-methoxyphenyl)-3-oxopropyl]sulfanyl/}ethyl/}-c-hydroxycarbonimidoyl)butanoic acid

Preferred term

2-amino-4-(/{1-[(carboxymethyl)-c-hydroxycarbonimidoyl]-2-/{[1-(2-hydroxy-4-methoxyphenyl)-3-oxopropyl]sulfanyl/}ethyl/}-c-hydroxycarbonimidoyl)butanoic acid  

Type

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

Broader concept

charge

  • 0

formula

  • C20H27N3O9S

inchi

  • InChI=1S/C20H27N3O9S/c1-32-11-2-3-12(15(25)8-11)16(6-7-24)33-10-14(19(29)22-9-18(27)28)23-17(26)5-4-13(21)20(30)31/h2-3,7-8,13-14,16,25H,4-6,9-10,21H2,1H3,(H,22,29)(H,23,26)(H,27,28)(H,30,31)

inchikey

  • PZTUENGKEHDYLI-UHFFFAOYSA-N

mass

  • 485.510

monoisotopicmass

  • 485.14680

smiles

  • S(C(C1=C(O)C=C(OC)C=C1)CC=O)CC(NC(=O)CCC(N)C(O)=O)C(=O)NCC(O)=O

subset

  • 2_STAR

synonym EXACT

  • 2-amino-5-[[1-(carboxymethylamino)-3-[1-(2-hydroxy-4-methoxyphenyl)-3-oxopropyl]sulanyl-1-oxopropan-2-yl]amino]-5-oxopentanoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:184195

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