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Details

Stereochemistry ABSOLUTE
Molecular Formula C6H10N2O4
Molecular Weight 174.1546
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-ACETYLASPARAGINE

SMILES

CC(=O)N[C@@H](CC(N)=O)C(O)=O

InChI

InChIKey=HXFOXFJUNFFYMO-BYPYZUCNSA-N
InChI=1S/C6H10N2O4/c1-3(9)8-4(6(11)12)2-5(7)10/h4H,2H2,1H3,(H2,7,10)(H,8,9)(H,11,12)/t4-/m0/s1

HIDE SMILES / InChI

Molecular Formula C6H10N2O4
Molecular Weight 174.1546
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

PubMed

PubMed

TitleDatePubMed
The apparent dependence of the diffusion coefficient of N-acetylaspartate upon magnetic field strength: evidence of an interaction with NMR methodology.
2003 Dec
Proton magnetic resonance spectroscopy in children with spastic diplegia.
2004 Jun 3
Aminoacylase I deficiency: a novel inborn error of metabolism.
2005 Dec 23
Evaluation of MR markers that predict survival in patients with newly diagnosed GBM prior to adjuvant therapy.
2009 Jan
Substance Class Chemical
Created
by admin
on Sat Dec 16 10:04:31 GMT 2023
Edited
by admin
on Sat Dec 16 10:04:31 GMT 2023
Record UNII
D0P42N84Z6
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N-ACETYLASPARAGINE
Systematic Name English
N-ACETYL-L-ASPARAGINE
Systematic Name English
NSC-186895
Code English
L-ASPARAGINE, N2-ACETYL-
Systematic Name English
.ALPHA.-N-ACETYL-L-ASPARAGINE
Common Name English
ASPARAGINE, N2-ACETYL-, L-
Systematic Name English
Code System Code Type Description
EVMPD
SUB33280
Created by admin on Sat Dec 16 10:04:31 GMT 2023 , Edited by admin on Sat Dec 16 10:04:31 GMT 2023
PRIMARY
CAS
4033-40-3
Created by admin on Sat Dec 16 10:04:31 GMT 2023 , Edited by admin on Sat Dec 16 10:04:31 GMT 2023
PRIMARY
ECHA (EC/EINECS)
223-716-7
Created by admin on Sat Dec 16 10:04:31 GMT 2023 , Edited by admin on Sat Dec 16 10:04:31 GMT 2023
PRIMARY
EPA CompTox
DTXSID401035921
Created by admin on Sat Dec 16 10:04:31 GMT 2023 , Edited by admin on Sat Dec 16 10:04:31 GMT 2023
PRIMARY
FDA UNII
D0P42N84Z6
Created by admin on Sat Dec 16 10:04:31 GMT 2023 , Edited by admin on Sat Dec 16 10:04:31 GMT 2023
PRIMARY
SMS_ID
100000126128
Created by admin on Sat Dec 16 10:04:31 GMT 2023 , Edited by admin on Sat Dec 16 10:04:31 GMT 2023
PRIMARY
PUBCHEM
99715
Created by admin on Sat Dec 16 10:04:31 GMT 2023 , Edited by admin on Sat Dec 16 10:04:31 GMT 2023
PRIMARY
NSC
186895
Created by admin on Sat Dec 16 10:04:31 GMT 2023 , Edited by admin on Sat Dec 16 10:04:31 GMT 2023
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT
SALT/SOLVATE -> PARENT