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CHEBI:35752 - pentetate(3−)

ChEBI IDCHEBI:35752
ChEBI Namepentetate(3−)
Stars
ASCII Namepentetate(3-)
Last Modified18 July 2006
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC14H20N3O10
Net Charge-3
Average Mass390.325
Monoisotopic Mass390.11651
SMILESO=C([O-])CN(CCN(CC(=O)[O-])CC(=O)O)CCN(CC(=O)[O-])CC(=O)O
InChIInChI=1S/C14H23N3O10/c18-10(19)5-15(1-3-16(6-11(20)21)7-12(22)23)2-4-17(8-13(24)25)9-14(26)27/h1-9H2,(H,18,19)(H,20,21)(H,22,23)(H,24,25)(H,26,27)/p-3
InChIKeyQPCDCPDFJACHGM-UHFFFAOYSA-K
ChEBI Ontology
Outgoing Relation(s)
pentetate(3−) (CHEBI:35752) is a pentacarboxylic acid anion (CHEBI:35755)
pentetate(3−) (CHEBI:35752) is conjugate acid of pentetate(4−) (CHEBI:35760)
pentetate(3−) (CHEBI:35752) is conjugate base of pentetate(2−) (CHEBI:35762)
Incoming Relation(s)
pentetate(2−) (CHEBI:35762) is conjugate acid of pentetate(3−) (CHEBI:35752)
pentetate(4−) (CHEBI:35760) is conjugate base of pentetate(3−) (CHEBI:35752)
IUPAC Name 
(bis{2-[(carboxylatomethyl)(carboxymethyl)amino]ethyl}amino)acetate
Synonyms  Source
H2dtpa3−ChEBI
H2dtpaIUPAC
dihydrogen diethylenetriaminepentaacetateChEBI
Registry NumbersSources
Beilstein:6546711Beilstein
Gmelin:385714Gmelin