Molecular Identity
Diethylenetriaminepentaacetic acid
2-[bis[2-[bis(carboxymethyl)amino]ethyl]amino]acetic acid
PubChem CID: 3053
Pentetic acid is a pentacarboxylic acid. It has a role as a copper chelator. It is a conjugate acid of a pentetate(1-).
2D Structure
Properties
C14H23N3O10
Molecular Formula
393.35
Molecular Weight
g/mol
393.1383
Exact Mass
Da
-8.5
XLogP
Drug-like (Lipinski: < 5)
196
TPSA
May have limited oral absorption
5
H-Bond Donors
13
H-Bond Acceptors
481
Complexity
SMILES
Canonical SMILES
SMILES: C(CN(CC(=O)O)CC(=O)O)N(CCN(CC(=O)O)CC(=O)O)CC(=O)OIsomeric SMILES
SMILES: C(CN(CC(=O)O)CC(=O)O)N(CCN(CC(=O)O)CC(=O)O)CC(=O)OSynonyms(20)
Pentetic aciddiethylenetriaminepentaacetic acid67-43-6DTPADetapacDetarexTitriplex VMonaquest CAIPerma kleerDabeersen 503CHEL 330 acidPenthanilPenthamilChel DTPADissolvine D
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to Diethylenetriaminepentaacetic acid
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