MassBank Record: KO000826



 L-Glutathione (reduced form); LC-ESI-QQ; MS2; CE:30 V; [M-H]- 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: KO000826
RECORD_TITLE: L-Glutathione (reduced form); LC-ESI-QQ; MS2; CE:30 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$MASS_SPECTROMETRY: COLLISION_ENERGY 30 V
MS$FOCUSED_ION: PRECURSOR_M/Z 306 MS$FOCUSED_ION: PRECURSOR_TYPE [M-H]-
PK$SPLASH: splash10-002f-2900000000-bd9ba27b48b1322b7618 PK$NUM_PEAK: 33 PK$PEAK: m/z int. rel.int. 59.300 103960.5 221 61.900 14851.5 32 74.100 64356.5 137 85.800 39604.0 84 95.400 24752.5 53 97.400 39604.0 84 98.700 108911.0 231 102.900 34653.5 74 109.800 39604.0 84 112.200 19802.0 42 126.900 29703.0 63 128.000 470297.5 999 129.500 34653.5 74 134.800 29703.0 63 140.600 99010.0 210 141.800 54455.5 116 143.100 405941.0 862 143.400 113861.5 242 145.000 59406.0 126 146.400 54455.5 116 154.500 24752.5 53 159.600 19802.0 42 167.100 49505.0 105 167.300 29703.0 63 170.600 19802.0 42 176.300 24752.5 53 179.100 99010.0 210 181.000 29703.0 63 192.100 14851.5 32 210.300 59406.0 126 253.900 14851.5 32 272.200 24752.5 53 306.800 99010.0 210 //