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Details

Stereochemistry ACHIRAL
Molecular Formula C12H14N2O5S
Molecular Weight 298.315
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-ACETYLSEROTONIN SULFATE

SMILES

CC(=O)NCCC1=CNC2=CC=C(OS(O)(=O)=O)C=C12

InChI

InChIKey=UCAJZNVFRVLULS-UHFFFAOYSA-N
InChI=1S/C12H14N2O5S/c1-8(15)13-5-4-9-7-14-12-3-2-10(6-11(9)12)19-20(16,17)18/h2-3,6-7,14H,4-5H2,1H3,(H,13,15)(H,16,17,18)

HIDE SMILES / InChI

Approval Year

Unknown
139594
Name Type Language
N-ACETYLSEROTONIN SULFATE
Common Name English
ACETAMIDE, N-(2-(5-(SULFOOXY)-1H-INDOL-3-YL)ETHYL)-
Systematic Name English
N-(2-(5-(SULFOOXY)-1H-INDOL-3-YL)ETHYL)ACETAMIDE
Systematic Name English
(3-(2-ACETAMIDOETHYL)-1H-INDOL-5-YL) HYDROGEN SULFATE
Systematic Name English
Code System Code Type Description
FDA UNII
6H27MNZ6FP
Created by admin on Sat Dec 16 16:34:02 GMT 2023 , Edited by admin on Sat Dec 16 16:34:02 GMT 2023
PRIMARY
CAS
94840-68-3
Created by admin on Sat Dec 16 16:34:02 GMT 2023 , Edited by admin on Sat Dec 16 16:34:02 GMT 2023
PRIMARY
EPA CompTox
DTXSID30670215
Created by admin on Sat Dec 16 16:34:02 GMT 2023 , Edited by admin on Sat Dec 16 16:34:02 GMT 2023
PRIMARY
PUBCHEM
45479248
Created by admin on Sat Dec 16 16:34:02 GMT 2023 , Edited by admin on Sat Dec 16 16:34:02 GMT 2023
PRIMARY
PARENT (METABOLITE)
Structure of MELATONIN
NIH
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