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Details

Stereochemistry ACHIRAL
Molecular Formula 2C4H11N3O.H2O4S
Molecular Weight 332.378
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CREATINOL SULFATE

SMILES

OS(O)(=O)=O.CN(CCO)C(N)=N.CN(CCO)C(N)=N

InChI

InChIKey=UXBBURPYFRPXAL-UHFFFAOYSA-N
InChI=1S/2C4H11N3O.H2O4S/c2*1-7(2-3-8)4(5)6;1-5(2,3)4/h2*8H,2-3H2,1H3,(H3,5,6);(H2,1,2,3,4)

HIDE SMILES / InChI

Molecular Formula H2O4S
Molecular Weight 98.078
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C4H11N3O
Molecular Weight 117.1496
Charge 0
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 10:20:54 GMT 2023
Edited
by admin
on Sat Dec 16 10:20:54 GMT 2023
Record UNII
3V2845U0LW
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CREATINOL SULFATE
Common Name English
DICREATINOL SULFATE
Common Name English
GUANIDINE, N-(2-HYDROXYETHYL)-N-METHYL-, SULFATE (2:1)
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID50198688
Created by admin on Sat Dec 16 10:20:54 GMT 2023 , Edited by admin on Sat Dec 16 10:20:54 GMT 2023
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PUBCHEM
45381533
Created by admin on Sat Dec 16 10:20:54 GMT 2023 , Edited by admin on Sat Dec 16 10:20:54 GMT 2023
PRIMARY
FDA UNII
3V2845U0LW
Created by admin on Sat Dec 16 10:20:54 GMT 2023 , Edited by admin on Sat Dec 16 10:20:54 GMT 2023
PRIMARY
CAS
50648-53-8
Created by admin on Sat Dec 16 10:20:54 GMT 2023 , Edited by admin on Sat Dec 16 10:20:54 GMT 2023
PRIMARY