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Details

Stereochemistry ACHIRAL
Molecular Formula C3H6OS
Molecular Weight 90.144
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of PROPANETHIAL S-OXIDE, (1E)-

SMILES

CC\C=[S+]\[O-]

InChI

InChIKey=BAZSXBOAXJLRNH-UHFFFAOYSA-N
InChI=1S/C3H6OS/c1-2-3-5-4/h3H,2H2,1H3

HIDE SMILES / InChI

Molecular Formula C3H6OS
Molecular Weight 90.144
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Aroma analysis of fresh and preserved onions and leek by dual solid-phase microextraction-liquid extraction and gas chromatography-mass spectrometry.
2002 Jul 19
Plant biochemistry: an onion enzyme that makes the eyes water.
2002 Oct 17
Allium discoloration: precursors involved in onion pinking and garlic greening.
2004 Aug 11
Bioactive S-alk(en)yl cysteine sulfoxide metabolites in the genus Allium: the chemistry of potential therapeutic agents.
2005 Jun
Applications of direct analysis in real time mass spectrometry (DART-MS) in Allium chemistry. 2-propenesulfenic and 2-propenesulfinic acids, diallyl trisulfane S-oxide, and other reactive sulfur compounds from crushed garlic and other Alliums.
2010 Apr 28
Using synthesized onion lachrymatory factor to measure age-related decreases in reflex-tear secretion and ocular-surface sensation.
2010 May
Substance Class Chemical
Created
by admin
on Sat Dec 16 00:42:38 GMT 2023
Edited
by admin
on Sat Dec 16 00:42:38 GMT 2023
Record UNII
TLN93NUR7S
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PROPANETHIAL S-OXIDE, (1E)-
Systematic Name English
PROPANETHIAL, S-OXIDE, (1E)-
Systematic Name English
PROPANETHIAL S-OXIDE E-ISOMER
Common Name English
E-PROPANETHIAL S-OXIDE
Common Name English
Code System Code Type Description
FDA UNII
TLN93NUR7S
Created by admin on Sat Dec 16 00:42:38 GMT 2023 , Edited by admin on Sat Dec 16 00:42:38 GMT 2023
PRIMARY
PUBCHEM
441491
Created by admin on Sat Dec 16 00:42:38 GMT 2023 , Edited by admin on Sat Dec 16 00:42:38 GMT 2023
PRIMARY PUBCHEM
CAS
74635-27-1
Created by admin on Sat Dec 16 00:42:38 GMT 2023 , Edited by admin on Sat Dec 16 00:42:38 GMT 2023
PRIMARY