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Details

Stereochemistry RACEMIC
Molecular Formula C5H6N2O5.Ca
Molecular Weight 214.19
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CALCIUM N-CARBAMOYLASPARTATE, DL-

SMILES

[Ca++].NC(=O)NC(CC([O-])=O)C([O-])=O

InChI

InChIKey=KGWAITXYALRFDQ-UHFFFAOYSA-L
InChI=1S/C5H8N2O5.Ca/c6-5(12)7-2(4(10)11)1-3(8)9;/h2H,1H2,(H,8,9)(H,10,11)(H3,6,7,12);/q;+2/p-2

HIDE SMILES / InChI

Molecular Formula Ca
Molecular Weight 40.078
Charge 2
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C5H6N2O5
Molecular Weight 174.1115
Charge -2
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 10:46:06 GMT 2023
Edited
by admin
on Sat Dec 16 10:46:06 GMT 2023
Record UNII
F9OP81SI6Q
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CALCIUM N-CARBAMOYLASPARTATE, DL-
Common Name English
ASPARTIC ACID, N-CARBAMOYL-, CALCIUM SALT (1:1), DL-
Systematic Name English
CALCIUM N-CARBAMOYLASPARTATE DL-FORM [MI]
Common Name English
Code System Code Type Description
FDA UNII
F9OP81SI6Q
Created by admin on Sat Dec 16 10:46:06 GMT 2023 , Edited by admin on Sat Dec 16 10:46:06 GMT 2023
PRIMARY
CAS
30905-63-6
Created by admin on Sat Dec 16 10:46:06 GMT 2023 , Edited by admin on Sat Dec 16 10:46:06 GMT 2023
PRIMARY
EPA CompTox
DTXSID30953075
Created by admin on Sat Dec 16 10:46:06 GMT 2023 , Edited by admin on Sat Dec 16 10:46:06 GMT 2023
PRIMARY
ECHA (EC/EINECS)
250-383-5
Created by admin on Sat Dec 16 10:46:06 GMT 2023 , Edited by admin on Sat Dec 16 10:46:06 GMT 2023
PRIMARY
PUBCHEM
35676
Created by admin on Sat Dec 16 10:46:06 GMT 2023 , Edited by admin on Sat Dec 16 10:46:06 GMT 2023
PRIMARY
MERCK INDEX
m1052
Created by admin on Sat Dec 16 10:46:06 GMT 2023 , Edited by admin on Sat Dec 16 10:46:06 GMT 2023
PRIMARY Merck Index