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Details

Stereochemistry ACHIRAL
Molecular Formula C13H16N2O6S
Molecular Weight 328.341
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 6-SULFATOXYMELATONIN

SMILES

COC1=CC2=C(NC=C2CCNC(C)=O)C=C1OS(O)(=O)=O

InChI

InChIKey=QQEILXDLZRLTME-UHFFFAOYSA-N
InChI=1S/C13H16N2O6S/c1-8(16)14-4-3-9-7-15-11-6-13(21-22(17,18)19)12(20-2)5-10(9)11/h5-7,15H,3-4H2,1-2H3,(H,14,16)(H,17,18,19)

HIDE SMILES / InChI

Molecular Formula C13H16N2O6S
Molecular Weight 328.341
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 08:39:02 UTC 2023
Edited
by admin
on Sat Dec 16 08:39:02 UTC 2023
Record UNII
XS8Z7GXT5E
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
6-SULFATOXYMELATONIN
Common Name English
6-(SULFONYLOXY)MELATONIN
Common Name English
6-HYDROXYMELATONIN SULFATE
Common Name English
N-(2-(5-METHOXY-6-(SULFOOXY)-1H-INDOL-3-YL)ETHYL)ACETAMIDE
Systematic Name English
ACETAMIDE, N-(2-(5-METHOXY-6-(SULFOOXY)-1H-INDOL-3-YL)ETHYL)-
Systematic Name English
Code System Code Type Description
FDA UNII
XS8Z7GXT5E
Created by admin on Sat Dec 16 08:39:02 UTC 2023 , Edited by admin on Sat Dec 16 08:39:02 UTC 2023
PRIMARY
NCI_THESAURUS
C192638
Created by admin on Sat Dec 16 08:39:02 UTC 2023 , Edited by admin on Sat Dec 16 08:39:02 UTC 2023
PRIMARY
CAS
2208-40-4
Created by admin on Sat Dec 16 08:39:02 UTC 2023 , Edited by admin on Sat Dec 16 08:39:02 UTC 2023
PRIMARY
PUBCHEM
65096
Created by admin on Sat Dec 16 08:39:02 UTC 2023 , Edited by admin on Sat Dec 16 08:39:02 UTC 2023
PRIMARY
EPA CompTox
DTXSID40176576
Created by admin on Sat Dec 16 08:39:02 UTC 2023 , Edited by admin on Sat Dec 16 08:39:02 UTC 2023
PRIMARY
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