MOLI000805
Molecular Formula:
C26H36N2O6Tc
InChI: InChI=1/C26H36N2O6.Tc/c1-25(2,3)15-7-9-19(29)17(13-15)21(23(31)32)27-11-12-28-22(24(33)34)18-14-16(26(4,5)6)8-10-20(18)30;/h7-10,13-14,21-22,27-30H,11-12H2,1-6H3,(H,31,32)(H,33,34);/i;1+1/f/h31,33H;
InChIKey: InChIKey=PYJGDADTHPZSBO-GAWWYAGJGP
SMILES: CC(C)(C)C1=CC(=C(C=C1)O)C(C(=O)O)NCCNC(C2=C(C=CC(=C2)C(C)(C)C)O)C(=O)O.[Tc]
Names:
MOLI000805
2-[2-[[carboxy-(2-hydroxy-5-tert-butyl-phenyl)methyl]amino]ethylamino]-2-(2-hydroxy-5-tert-butyl-phenyl)acetic acid; technetium
Registries:
PubChem CID 450370
PubChem ID 789
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