CHEBI:139389 - thiocitrulline

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ChEBI Name thiocitrulline
ChEBI ID CHEBI:139389
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C6H13N3O2S
Net Charge 0
Average Mass 191.253
Monoisotopic Mass 191.07285
InChI InChI=1S/C6H13N3O2S/c7-4(5(10)11)2-1-3-9-6(8)12/h4H,1-3,7H2,(H,10,11)(H3,8,9,12)
InChIKey BKGWACHYAMTLAF-UHFFFAOYSA-N
SMILES S=C(NCCCC(N)C(O)=O)N
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
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ChEBI Ontology
Outgoing thiocitrulline (CHEBI:139389) is a α-amino acid (CHEBI:33704)
Manual Xref Database
2600221 ChemSpider
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Last Modified
09 January 2018