MassBank Record: KO001582



 5-Phosphorylribose 1-pyrophosphate; LC-ESI-QQ; MS2; CE:20 V; [M-H]- 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: KO001582
RECORD_TITLE: 5-Phosphorylribose 1-pyrophosphate; LC-ESI-QQ; MS2; CE:20 V; [M-H]-
DATE: 2016.01.19 (2007.07.07, 2011.05.10)
AUTHORS: Kakazu YInstitute for Advanced Biosciences, Keio Univ., Horai HInstitute for Advanced Biosciences, Keio Univ., 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$LINK: PUBCHEM SID:3419 CH$LINK: INCHIKEY PQGCEDQWHSBAJP-AIHAYLRMSA-N
AC$INSTRUMENT: API3000, Applied Biosystems AC$INSTRUMENT_TYPE: LC-ESI-QQ AC$MASS_SPECTROMETRY: MS_TYPE MS2 AC$MASS_SPECTROMETRY: ION_MODE NEGATIVE AC$MASS_SPECTROMETRY: COLLISION_ENERGY 20 V
MS$FOCUSED_ION: PRECURSOR_M/Z 389 MS$FOCUSED_ION: PRECURSOR_TYPE [M-H]-
PK$SPLASH: splash10-0006-0292000000-4b0921b5f9a435fd6860 PK$NUM_PEAK: 18 PK$PEAK: m/z int. rel.int. 59.500 24752.5 43 95.100 49505.0 87 176.900 277228.0 486 217.100 69307.0 122 225.000 39604.0 69 236.100 24752.5 43 239.000 14851.5 26 248.000 24752.5 43 252.200 44554.5 78 256.900 19802.0 35 269.000 14851.5 26 281.500 29703.0 52 290.800 569307.5 999 299.200 19802.0 35 307.100 24752.5 43 312.800 19802.0 35 331.000 54455.5 96 389.100 173267.5 304 //