Chem
J-GLOBAL ID：201007096120502199   Nikkaji number：J2.846.921G

5,5′-[Dithiobis[[3-oxo-3-(2-oxo-2-hydroxyethylamino)propane-1,2-diyl]imino]]bis(2-amino-5-oxovaleric acid)

5,5′-[ジチオビス[[3-オキソ-3-(2-オキソ-2-ヒドロキシエチルアミノ)プロパン-1,2-ジイル]イミノ]]ビス(2-アミノ-5-オキソ吉草酸)
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C20H32N6O12S2
Molecular formula furigana： C20-H32-N6-O12-S2
Molecular weight： 612.630
InChI： InChI=1S/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)
InChI key： YPZRWBKMTBYPTK-UHFFFAOYSA-N
SMILES： NC(CCC(=O)NC(CSSCC(NC(=O)CCC(N)C(=O)O)C(=O)NCC(=O)O)C(=O)NCC(=O)O)C(=O)O
Systematic name  (3)：
  • 5,5′-[ジチオビス[[3-オキソ-3-(2-オキソ-2-ヒドロキシエチルアミノ)プロパン-1,2-ジイル]イミノ]]ビス(2-アミノ-5-オキソ吉草酸)
  • 2-アミノ-4-[(2-{[2-(4-アミノ-4-カルボキシブタンアミド)-2-[(カルボキシメチル)カルバモイル]エチル]ジスルファニル}-1-[(カルボキシメチル)カルバモイル]エチル)カルバモイル]ブタン酸
  • 2-amino-4-[(2-{[2-(4-amino-4-carboxybutanamido)-2-[(carboxymethyl)carbamoyl]ethyl]disulfanyl}-1-[(carboxymethyl)carbamoyl]ethyl)carbamoyl]butanoic acid
Other name (1)：
  • 5,5′-[Dithiobis[[3-oxo-3-(2-oxo-2-hydroxyethylamino)propane-1,2-diyl]imino]]bis(2-amino-5-oxovaleric acid)
Thsaurus map：
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