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5,5'-dimethyl-BAPTA

PropertiesImage
MNX_IDMNXM37887 Image of MNXM37887
referencechebi:60889
formulaC24H28N2O10
global charge0
mol weight504.492
InChIKeyBOMWLYNXTGNSSE-UHFFFAOYSA-N
InChIInChI=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)
SMILESCC1=CC=C(N(CC(=O)O)CC(=O)O)C(OCCOC2=C(N(CC(=O)O)CC(=O)O)C=CC(C)=C2)=C1
MNX internals
InChI (mnx)InChI=1/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) Image of MNXM37887
SMILES (mnx)[CH3:1][C:15]1=[CH:9][C:19]([O:35][CH2:7][CH2:8][O:36][C:20]2=[C:18]([N:26]([CH2:13][C:23](=[O:31])[OH:32])[CH2:14][C:24](=[O:33])[OH:34])[CH:6]=[CH:4][C:16]([CH3:2])=[CH:10]2)=[C:17]([N:25]([CH2:11][C:21](=[O:27])[OH:28])[CH2:12][C:22](=[O:29])[OH:30])[CH:5]=[CH:3]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:60889
chebi:60889
BOMWLYNXTGNSSE-UHFFFAOYSA-N 		5,5'-dimethyl-BAPTA
(CH3)2-Bapta
2,2',2'',2'''-{ethane-1,2-diylbis[oxy(4-methyl-2,1-phenylene)nitrilo]}tetraacetic acid
5,5'-Dimethyl-bapta
5,5'-Dimethyl-bis(2-aminophenoxy)ethane-N,N,N',N'-tetraacetate
Bis(2-amino-5-methylphenoxy)ethane-N,N,N',N'-tetraacetate
Dimethyl bis-(2-aminophenoxy)ethane-N,N,N',N'-tetraacetic acid
Maptam
N,N'-(1,2-ethanediylbis(oxy(4-methyl-2,1-phenylene)))bis(N-(carboxymethyl))glycine