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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 > oligopeptide > s-(9-hydroxy-pga1)-glutathione
organooxygen compound > carboxamide > peptide > oligopeptide > s-(9-hydroxy-pga1)-glutathione
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > amide > primary amide > carboxamide > peptide > oligopeptide > s-(9-hydroxy-pga1)-glutathione
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic amino compound > peptide > oligopeptide > s-(9-hydroxy-pga1)-glutathione
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > organic amino compound > peptide > oligopeptide > s-(9-hydroxy-pga1)-glutathione

Preferred term

s-(9-hydroxy-pga1)-glutathione  

Type

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

Broader concept

charge

  • 0

formula

  • C30H51N3O10S

inchi

  • InChI=1S/C30H51N3O10S/c1-2-3-6-9-19(34)12-13-21-20(10-7-4-5-8-11-27(37)38)24(35)16-25(21)44-18-23(29(41)32-17-28(39)40)33-26(36)15-14-22(31)30(42)43/h12-13,19-25,34-35H,2-11,14-18,31H2,1H3,(H,32,41)(H,33,36)(H,37,38)(H,39,40)(H,42,43)/b13-12+/t19-,20+,21-,22+,23+,24?,25?/m0/s1

inchikey

  • NQVXHXBSCJHHMO-LJAYPFBRSA-N

mass

  • 645.810

monoisotopicmass

  • 645.32952

smiles

  • S(C1[C@H]([C@H](C(O)C1)CCCCCCC(O)=O)/C=C/[C@@H](O)CCCCC)C[C@@H](NC(=O)CC[C@@H](N)C(O)=O)C(=O)NCC(O)=O

subset

  • 2_STAR

synonym EXACT

  • 7-[(1R,2S)-3-[(2S)-2-[[(4R)-4-amino-4-carboxybutanoyl]amino]-3-(carboxymethylamino)-3-oxopropyl]sulanyl-5-hydroxy-2-[(E,3S)-3-hydroxyoct-1-enyl]cyclopentyl]heptanoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:185716

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