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CHEBI:46601 - 7,10,13-TRI(CARBOXYMETHYL)-5,15-DIOXO-4,7,10,13,16-PENTAAZA-1,19-DITHIANONADECANE

Default Structure
ChEBI IDCHEBI:46601
ChEBI Name7,10,13-TRI(CARBOXYMETHYL)-5,15-DIOXO-4,7,10,13,16-PENTAAZA-1,19-DITHIANONADECANE
Stars
Last Modified16 May 2008
DownloadsMolfile
FormulaC18H33N5O8S2
Net Charge0
Average Mass511.623
Monoisotopic Mass511.17706
SMILES[H]OC(=O)C([H])([H])N(C([H])([H])C(=O)N([H])C([H])([H])C([H])([H])S[H])C([H])([H])C([H])([H])N(C([H])([H])C(=O)O[H])C([H])([H])C([H])([H])N(C([H])([H])C(=O)O[H])C([H])([H])C(=O)N([H])C([H])([H])C([H])([H])S[H]
InChIInChI=1S/C18H33N5O8S2/c24-14(19-1-7-32)9-22(12-17(28)29)5-3-21(11-16(26)27)4-6-23(13-18(30)31)10-15(25)20-2-8-33/h32-33H,1-13H2,(H,19,24)(H,20,25)(H,26,27)(H,28,29)(H,30,31)
InChIKeyMRDWXQKAAKNXSP-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
7,10,13-TRI(CARBOXYMETHYL)-5,15-DIOXO-4,7,10,13,16-PENTAAZA-1,19-DITHIANONADECANE (CHEBI:46601) is a unclassifieds (CHEBI:27189)
Synonyms  Source
7,10,13-TRI(CARBOXYMETHYL)-5,15-DIOXO-4,7,10,13,16-PENTAAZA-1,19-DITHIANONADECANEPDBeChem
N,N-bis{2-[(carboxymethyl){2-oxo-2-[(2-sulfanylethyl)amino]ethyl}amino]ethyl}glycinePDBeChem
Manual XrefsDatabases
YMAPDBeChem