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L-(+)-Ergothioneine

L-(+)-Ergothioneine

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For Research Use Only | Not For Clinical Use

CAT	APS497303
CAS	497-30-3
Structure
MDL Number	MFCD00167474
Synonyms	2-Mercaptohistidine betaine, thiotaine,1H-Imidazole-4-ethanaminium, α-carboxy-2,3-dihydro-N,N,N-trimethyl-2-thioxo-, inner salt, (αS)-, Histidine, 2-mercapto-N,N-dimethyl-, betaine, 2-Mercapto-N,N-dimethylhistidine methyl ester betaine, Thiasine, Thioneine, Sympectothion, 2-Mercaptohistidine trimethylbetaine, Ammonium, [1-carboxy-2-(2-mercaptoimidazol-4-yl)ethyl]trimethyl-, hydroxide, inner salt, L-(+)- (8CI), Phytothioneine, 1H-Imidazole-4-ethanaminium, α-carboxy-2,3-dihydro-N,N,N-trimethyl-2-thioxo-, hydroxide, inner salt, (S)-, Ergothioneine, Thiotane, Histidine, 2-mercapto-, trimethylbetaine, Ergothionine, L-Ergothioneine, NSC 7175, 1H-Imidazole-4-ethanaminium, α-carboxy-2,3-dihydro-N,N,N-trimethyl-2-thioxo-, inner salt, (S)-
IUPAC Name	(2S)-3-(2-sulfanylidene-1,3-dihydroimidazol-4-yl)-2-(trimethylazaniumyl)propanoate
Molecular Weight	229.30
Molecular Formula	C9H15N3O2S
EC Number	207-843-5
Canonical SMILES	C[N+](C)(C)[C@@H](CC1=CNC(=S)N1)C(=O)[O-]
InChI	InChI=1S/C9H15N3O2S/c1-12(2,3)7(8(13)14)4-6-5-10-9(15)11-6/h5,7H,4H2,1-3H3,(H2-,10,11,13,14,15)/t7-/m0/s1
InChI Key	SSISHJJTAXXQAX-ZETCQYMHSA-N

Accurate Mass	229.0885
Format	Neat
Shipping	Room Temperature
Size	10MG
Storage Conditions	-20°C Freezer
Subcategory	Food additives, flavours and adulterants

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