Terminology Service for NFDI4Health

5,5'-dimethyl-BAPTA

Go to external page http://purl.obolibrary.org/obo/CHEBI_60889


A polyamino carboxylic acid, the structure of which is that of BAPTA carrying methyl substituents at C-5 and C-5'.

Term info

Label

5,5'-dimethyl-BAPTA

Synonyms
  • 2,2',2'',2'''-{ethane-1,2-diylbis[oxy(4-methyl-2,1-phenylene)nitrilo]}tetraacetic acid
  • 5,5'-Dimethyl-bapta
database cross reference
Subsets

3_STAR

IUPAC NAME
2,2',2'',2'''-{ethane-1,2-diylbis[oxy(4-methyl-2,1-phenylene)nitrilo]}tetraacetic acid [ IUPAC ]

charge

0

formula

C24H28N2O10

has obo namespace

chebi_ontology

has related synonym

Dimethyl bis-(2-aminophenoxy)ethane-N,N,N',N'-tetraacetic acid, Maptam, (CH3)2-Bapta, N,N'-(1,2-ethanediylbis(oxy(4-methyl-2,1-phenylene)))bis(N-(carboxymethyl))glycine, 5,5'-Dimethyl-bis(2-aminophenoxy)ethane-N,N,N',N'-tetraacetate, Bis(2-amino-5-methylphenoxy)ethane-N,N,N',N'-tetraacetate

id

CHEBI:60889

inchi

InChI=1S/C24H28N2O10/c1-15-3-5-17(25(11-21(27)28)12-22(29)30)19(9-15)35-7-8-36-20-10-16(2)4-6-18(20)26(13-23(31)32)14-24(33)34/h3-6,9-10H,7-8,11-14H2,1-2H3,(H,27,28)(H,29,30)(H,31,32)(H,33,34)

inchikey

BOMWLYNXTGNSSE-UHFFFAOYSA-N

mass

504.48650

monoisotopicmass

504.17440

smiles

Cc1ccc(N(CC(O)=O)CC(O)=O)c(OCCOc2cc(C)ccc2N(CC(O)=O)CC(O)=O)c1