MassBank Record: KO001584



 5-Phosphorylribose 1-pyrophosphate; LC-ESI-QQ; MS2; CE:40 V; [M-H]- 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: KO001584
RECORD_TITLE: 5-Phosphorylribose 1-pyrophosphate; LC-ESI-QQ; MS2; CE:40 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 P023

CH$NAME: 5-Phosphorylribose 1-pyrophosphate CH$NAME: PRPP CH$NAME: 5-Phosphoribosyl 1-pyrophosphate CH$NAME: 5-Phospho-alpha-D-ribose 1-diphosphate CH$NAME: 5-Phosphoribosyl diphosphate CH$COMPOUND_CLASS: N/A CH$FORMULA: C5H13O14P3 CH$EXACT_MASS: 389.95181 CH$SMILES: O[C@@H]([C@@H](O)1)[C@@H](COP(O)(O)=O)O[C@H]1OP(O)(=O)OP(O)(O)=O CH$IUPAC: InChI=1S/C5H13O14P3/c6-3-2(1-16-20(8,9)10)17-5(4(3)7)18-22(14,15)19-21(11,12)13/h2-7H,1H2,(H,14,15)(H2,8,9,10)(H2,11,12,13)/t2-,3-,4-,5+/m1/s1 CH$LINK: CHEBI 17111 CH$LINK: KEGG C00119 CH$LINK: PUBCHEM SID:3419
AC$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 40 V
MS$FOCUSED_ION: PRECURSOR_M/Z 389 MS$FOCUSED_ION: PRECURSOR_TYPE [M-H]-
PK$SPLASH: splash10-056v-9700000000-bd45ef4b3b13a2ede00e PK$NUM_PEAK: 13 PK$PEAK: m/z int. rel.int. 59.200 29703.0 182 79.100 163366.5 999 93.100 34653.5 212 94.800 59406.0 363 96.900 118812.0 727 148.700 29703.0 182 158.800 133663.5 817 167.800 29703.0 182 174.900 14851.5 91 176.100 14851.5 91 177.200 94059.5 575 193.000 39604.0 242 240.800 14851.5 91 //