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(Q105219259)
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English
(5S)-5-(2-Propenyl)oxazolidine-2-thione
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
oxazolidine alkaloid
0 references
mass
143.040484908
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₆H₉NOS
0 references
canonical SMILES
SC1=NCC(O1)CC=C
0 references
isomeric SMILES
C=CC[C@H]1CN=C(S)O1
0 references
found in taxon
Brassica campestris
1 reference
stated in
Isolation of (−)-5-allyl-2-thiooxazolidone from Brassica napus L.
Brassica rapa
1 reference
stated in
Isolation of (−)-5-allyl-2-thiooxazolidone from Brassica napus L.
rapeseed
1 reference
stated in
Isolation of (−)-5-allyl-2-thiooxazolidone from Brassica napus L.
Identifiers
InChI
InChI=1S/C6H9NOS/c1-2-3-5-4-7-6(9)8-5/h2,5H,1,3-4H2,(H,7,9)/t5-/m0/s1
0 references
InChIKey
QEKDLBSHZCJKRO-YFKPBYRVSA-N
0 references
CAS Registry Number
15216-29-2
1 reference
stated in
CAS (formerly Chemical Abstracts Service)
retrieved
25 January 2022
PubChem CID
55286434
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
QEKDLBSHZCJKRO-YFKPBYRVSA-N
UniChem compound ID
64873568
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID001266847
1 reference
matched by identifier from
InChIKey
InChIKey
QEKDLBSHZCJKRO-YFKPBYRVSA-N
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