MassBank Record: KO000824



 L-Glutathione (reduced form); LC-ESI-QQ; MS2; CE:10 V; [M-H]- 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: KO000824
RECORD_TITLE: L-Glutathione (reduced form); LC-ESI-QQ; MS2; CE:10 V; [M-H]-
DATE: 2016.01.19 (Created 2007.07.07, modified 2011.05.10)
AUTHORS: Kakazu Y, Horai H, Institute for Advanced Biosciences, Keio Univ.
LICENSE: CC BY-NC-SA
COMMENT: KEIO_ID G009

CH$NAME: Glutathione CH$NAME: Reduced glutathione CH$NAME: gamma-L-Glutamyl-L-cysteinyl-glycine CH$NAME: GSH CH$NAME: N-(N-gamma-L-Glutamyl-L-cysteinyl)glycine CH$NAME: 5-L-Glutamyl-L-cysteinylglycine CH$NAME: L-Glutathione (reduced form) CH$COMPOUND_CLASS: N/A CH$FORMULA: C10H17N3O6S CH$EXACT_MASS: 307.08381 CH$SMILES: OC(=O)CNC(=O)C(CS)NC(=O)CCC(N)C(O)=O CH$IUPAC: InChI=1S/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/t5-,6-/m0/s1 CH$LINK: CAS 70-18-8 CH$LINK: CHEBI 16856 CH$LINK: CHEMPDB GSH CH$LINK: KEGG C00051 CH$LINK: NIKKAJI J10.686K CH$LINK: PUBCHEM SID:3353
AC$INSTRUMENT: API3000, Applied Biosystems AC$INSTRUMENT_TYPE: LC-ESI-QQ AC$MASS_SPECTROMETRY: MS_TYPE MS2 AC$MASS_SPECTROMETRY: ION_MODE NEGATIVE AC$MASS_SPECTROMETRY: COLLISION_ENERGY 10 V
MS$FOCUSED_ION: PRECURSOR_M/Z 306 MS$FOCUSED_ION: PRECURSOR_TYPE [M-H]-
PK$SPLASH: splash10-0a4i-0009000000-9b01fba547d1fcde113a PK$NUM_PEAK: 14 PK$PEAK: m/z int. rel.int. 128.100 19802.0 5 141.200 237624.0 55 141.800 153465.5 35 145.700 14851.5 3 224.600 54455.5 13 252.500 19802.0 5 270.400 24752.5 6 272.000 89109.0 21 272.800 54455.5 13 273.800 29703.0 7 288.000 34653.5 8 306.300 4341588.5 999 308.300 24752.5 6 340.000 44554.5 10 //