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CHEBI:176509 - D-buthionine-(S,R)-sulfoximine

ChEBI IDCHEBI:176509
ChEBI NameD-buthionine-(S,R)-sulfoximine
Stars
ASCII NameD-buthionine-(S,R)-sulfoximine
DefinitionA 2-amino-4-(S-butylsulfonimidoyl)butanoic acid which has R-configuration.
Last Modified14 June 2021
SubmitterAdnan
DownloadsMolfile
FormulaC8H18N2O3S
Net Charge0
Average Mass222.310
Monoisotopic Mass222.10381
SMILESCCCCS(=N)(=O)CC[C@@H](N)C(=O)O
InChIInChI=1S/C8H18N2O3S/c1-2-3-5-14(10,13)6-4-7(9)8(11)12/h7,10H,2-6,9H2,1H3,(H,11,12)/t7-,14?/m1/s1
InChIKeyKJQFBVYMGADDTQ-SKKCEABJSA-N
Roles Classification
Chemical Roles:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
D-buthionine-(S,R)-sulfoximine (CHEBI:176509) is a 2-amino-4-(S-butylsulfonimidoyl)butanoic acid (CHEBI:176510)
Incoming Relation(s)
S-butyl-DL-homocysteine (S,R)-sulfoximine (CHEBI:28714) has part D-buthionine-(S,R)-sulfoximine (CHEBI:176509)
IUPAC Name 
(2R)-2-amino-4-(S-butylsulfonimidoyl)butanoic acid
Synonyms  Source
D-buthionine sulfoximineChEBI
D-BSOChEBI
(R)-2-amino-4-(S-butylsulfonimidoyl)butyric acidChEBI
(R)-buthionine sulfoximineChEBI
(2R)-2-amino-4-(butylsulfonimidoyl)butanoic acidChEBI
Registry NumbersSources
CAS:113158-69-3ChEBI