α1-[3-[(2-Aminoethyl)amino]-3-oxopropyl]hexahydro-1H-1,4,7-triazonine-1,4,7-triacetic acid, ≥95%

cas: 1630114-57-6 — see every product listed under this CAS number, including other names

α1-[3-[(2-Aminoethyl)amino]-3-oxopropyl]hexahydro-1H-1,4,7-triazonine-1,4,7-triacetic acid, ≥95% (CAS 1630114-57-6) is a chemical reagent available from Chemat. Available pack sizes: 5mg, 25mg, 100mg. Offered by: Chemat.

• 2D
• 3D

5-(2-aminoethylamino)-2-[4,7-bis(carboxymethyl)-1,4,7-triazonan-1-yl]-5-oxopentanoic acid (CAS 1630114-57-6) is a chemical compound with the molecular formula C17H31N5O7 and a molecular weight of 417.5 g/mol. IUPAC name: 5-(2-aminoethylamino)-2-[4,7-bis(carboxymethyl)-1,4,7-triazonan-1-yl]-5-oxopentanoic acid. InChIKey: DTPTWBYXQVMEMQ-UHFFFAOYSA-N.

Identity

Molecular formula	C17H31N5O7
Molecular weight	417.5 g/mol
IUPAC name	5-(2-aminoethylamino)-2-[4,7-bis(carboxymethyl)-1,4,7-triazonan-1-yl]-5-oxopentanoic acid
InChIKey	DTPTWBYXQVMEMQ-UHFFFAOYSA-N
SMILES	C1CN(CCN(CCN1CC(=O)O)C(CCC(=O)NCCN)C(=O)O)CC(=O)O

Computed by PubChem (NCBI)

Isomers (same molecular formula)

(2S)-6-amino-2-[[2-[[2-[[2-[(2-methylpropan-2-yl)oxycarbonylamino]acetyl]amino]acetyl]amino]acetyl]amino]hexanoic acid C₁₇H₃₁N₅O₇