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Details

Stereochemistry RACEMIC
Molecular Formula 2C6H12NO3S.Ca
Molecular Weight 396.537
Optical Activity ( + / - )
Defined Stereocenters 0 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CALCIUM N-(HYDROXYMETHYL)-DL-METHIONATE

SMILES

[Ca++].CSCCC(NCO)C([O-])=O.CSCCC(NCO)C([O-])=O

InChI

InChIKey=NWNPLGLJNZEMTE-UHFFFAOYSA-L
InChI=1S/2C6H13NO3S.Ca/c2*1-11-3-2-5(6(9)10)7-4-8;/h2*5,7-8H,2-4H2,1H3,(H,9,10);/q;;+2/p-2

HIDE SMILES / InChI

Molecular Formula C6H12NO3S
Molecular Weight 178.229
Charge -1
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

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

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:09:56 GMT 2023
Edited
by admin
on Sat Dec 16 08:09:56 GMT 2023
Record UNII
I9A0U04D6I
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CALCIUM N-(HYDROXYMETHYL)-DL-METHIONATE
Common Name English
CALCIUM N-(HYDROXYMETHYL)METHIONATE, DL-
Common Name English
CALCIUM N-(HYDROXYMETHYL)-DL-METHIONATE (1:2)
Common Name English
DL-METHIONINE, N-(HYDROXYMETHYL)-, CALCIUM SALT (2:1)
Systematic Name English
METHIONINE, N-(HYDROXYMETHYL)-, CALCIUM SALT (2:1)
Systematic Name English
N-HYDROXYMETHYL-DL-METHIONINE CALCIUM SALT
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID40967345
Created by admin on Sat Dec 16 08:09:57 GMT 2023 , Edited by admin on Sat Dec 16 08:09:57 GMT 2023
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PUBCHEM
6452742
Created by admin on Sat Dec 16 08:09:57 GMT 2023 , Edited by admin on Sat Dec 16 08:09:57 GMT 2023
PRIMARY
FDA UNII
I9A0U04D6I
Created by admin on Sat Dec 16 08:09:57 GMT 2023 , Edited by admin on Sat Dec 16 08:09:57 GMT 2023
PRIMARY
ECHA (EC/EINECS)
258-235-1
Created by admin on Sat Dec 16 08:09:57 GMT 2023 , Edited by admin on Sat Dec 16 08:09:57 GMT 2023
PRIMARY
CAS
52886-07-4
Created by admin on Sat Dec 16 08:09:57 GMT 2023 , Edited by admin on Sat Dec 16 08:09:57 GMT 2023
PRIMARY