Molecular Identity
N-carbamoylaspartic acid
(2S)-2-(carbamoylamino)butanedioic acid
PubChem CID: 93072
N-carbamoyl-L-aspartic acid is the L-enantiomer N-carbamoylaspartic acid. It has a role as a metabolite. It is a N-carbamoyl-L-amino acid, a N-carbamoylaspartic acid and a L-aspartic acid derivative. It is a conjugate acid of a N-carbamoyl-L-aspartate(2-).
2D Structure
Properties
C5H8N2O5
Molecular Formula
176.13
Molecular Weight
g/mol
176.0433
Exact Mass
Da
-1.9
XLogP
Drug-like (Lipinski: < 5)
130
TPSA
Good oral absorption (< 140 A²)
4
H-Bond Donors
5
H-Bond Acceptors
214
Complexity
SMILES
Canonical SMILES
SMILES: C(C(C(=O)O)NC(=O)N)C(=O)OIsomeric SMILES
SMILES: C([C@@H](C(=O)O)NC(=O)N)C(=O)OSynonyms(20)
N-Carbamoyl-L-aspartic acid13184-27-5N-Carbamoylaspartic acidL-Ureidosuccinic acidUreidosuccinateCarbamoylaspartic acidN-Carbamoyl-S-aspartic acidCarbamyl-L-aspartic acidL-N-Carbamoylaspartic acidSuccinic acid, ureido-Carbamylaspartic acidAspartic acid, N-carbamoyl-2-Ureidobutanedioic acidL-Aspartic acid, N-(aminocarbonyl)-EINECS 236-134-3
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to N-carbamoylaspartic acid
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