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Details

Stereochemistry ABSOLUTE
Molecular Formula 2C7H13NO3S.Ca
Molecular Weight 422.574
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 2

SHOW SMILES / InChI
Structure of ACETYLMETHIONINE CALCIUM

SMILES

[Ca++].CSCC[C@H](NC(C)=O)C(O)=O.CSCC[C@H](NC(C)=O)C(O)=O

InChI

InChIKey=RSLXYULLPVSFOZ-UAIGZDOSSA-N
InChI=1S/2C7H13NO3S.Ca/c2*1-5(9)8-6(7(10)11)3-4-12-2;/h2*6H,3-4H2,1-2H3,(H,8,9)(H,10,11);/q;;+2/t2*6-;/m00./s1

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 C7H12NO3S
Molecular Weight 190.24
Charge -1
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 10:57:44 GMT 2023
Edited
by admin
on Sat Dec 16 10:57:44 GMT 2023
Record UNII
VKK65T8A9U
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ACETYLMETHIONINE CALCIUM
Systematic Name English
L-METHIONINE, N-ACETYL-, CALCIUM SALT (2:1)
Systematic Name English
Code System Code Type Description
CAS
79266-75-4
Created by admin on Sat Dec 16 10:57:44 GMT 2023 , Edited by admin on Sat Dec 16 10:57:44 GMT 2023
PRIMARY
PUBCHEM
92135772
Created by admin on Sat Dec 16 10:57:44 GMT 2023 , Edited by admin on Sat Dec 16 10:57:44 GMT 2023
PRIMARY
FDA UNII
VKK65T8A9U
Created by admin on Sat Dec 16 10:57:44 GMT 2023 , Edited by admin on Sat Dec 16 10:57:44 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE