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S-methyl-L-ergothioneine

PropertiesImageOccurences in reactions
MNX_IDMNXM160935Image of MNXM160935
#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
formulaC10H17N3O2S
charge0
mass243.10415
referencechebi:76620
InChIKeyGVQNHIYBRMFCMS-QMMMGPOBSA-N
InChIInChI=1S/C10H17N3O2S/c1-13(2,3)8(9(14)15)5-7-6-11-10(12-7)16-4/h6,8H,5H2,1-4H3,(H-,11,12,14,15)/t8-/m0/s1
SMILESCSc1ncc(C[C@@H](C(=O)[O-])[N+](C)(C)C)[nH]1
Parent-child relations graph
 Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
CHEBI:76620
chebi:76620 		S-methyl-L-ergothioneine
(+)-L-S-methylergothioneine
(+)-L-methylergothioneine
(+)-S-methyl-L-ergothioneine
(+)-S-methylergothioneine
(2S)-3-(2-methylsulfanyl-1H-imidazol-5-yl)-2-(trimethylazaniumyl)propanoate
(2S)-3-[2-(methylsulfanyl)-1H-imidazol-4-yl]-2-(trimethylammonio)propanoate
(2S)-3-[2-(methylsulfanyl)-1H-imidazol-4-yl]-2-(trimethylammonio)propionate
7S-(+)-methylergothioneine
L-(+)-S-methylergothioneine
L-S-methylergothioneine
S-methylergothioneine
chebi:90131 secondary/obsolete/fantasy identifier