S-(1-hydroxy-3-methylhexan-3-yl)-L-cysteinylglycine zwitterion (CHEBI:145804)

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.

ChEBI Name	S-(1-hydroxy-3-methylhexan-3-yl)-L-cysteinylglycine zwitterion

ChEBI ID	CHEBI:145804

ChEBI ASCII Name	S-(1-hydroxy-3-methylhexan-3-yl)-L-cysteinylglycine zwitterion

Definition	An S-conjugate L-cysteinylglycine zwitterion substituted by a (1-hydroxy-3-methylhexan-3-yl) group; major species at pH 7.3.

Stars	This entity has been manually annotated by a third party.

Submitter	Anne Morgat

Supplier Information

Download	Molfile XML SDF

Formula

C12H24N2O4S

Net Charge

Average Mass

292.390

Monoisotopic Mass

292.14568

InChI

InChI=1S/C12H24N2O4S/c1-3-4-12(2,5-6-15)19-8-9(13)11(18)14-7-10(16)17/h9,15H,3-8,13H2,1-2H3,(H,14,18)(H,16,17)/t9-,12?/m0/s1

InChIKey

FIKNGFBNGIHRJV-QHGLUPRGSA-N

SMILES

CCCC(SC[C@@H](C(NCC([O-])=O)=O)[NH3+])(C)CCO

ChEBI Ontology
Outgoing	S-(1-hydroxy-3-methylhexan-3-yl)-L-cysteinylglycine zwitterion (CHEBI:145804) is a S-substituted L-cysteinylglycine zwitterion (CHEBI:143103)

Synonyms	Sources
S-(1-hydroxy-3-methylhexan-3-yl)-L-Cys-Gly	SUBMITTER
S-(1-hydroxy-3-methylhexan-3-yl)-L-cysteinylglycine	UniProt
S-(6-hydroxy-4-methylhexan-4-yl)-L-Cys-Gly	SUBMITTER
S-(6-hydroxy-4-methylhexan-4-yl)-L-cysteinylglycine zwitterion	SUBMITTER

Citation	Type	Source
18515361	PubMed citation	SUBMITTER