Analysis Metabolite Name Measured Value Units treatment pool aliquot
MS positive ion modecitric acid91Peak heightLumB no
MS positive ion modecitric acid246Peak heightLumB no
MS positive ion modecitric acid253Peak heightDCIS no
MS positive ion modecitric acid375Peak heightDCIS no
MS positive ion modecitric acid388Peak heightTotal Pool1 yes
MS positive ion modecitric acid512Peak heightDCIS no
MS positive ion modecitric acid523Peak heightDCIS no
MS positive ion modecitric acid1016Peak heightLumA no
MS positive ion modecitric acid1019Peak heightReduction no
MS positive ion modecitric acid1068Peak heightLumB no
MS positive ion modecitric acid1568Peak heightDCIS no
MS positive ion modecitric acid1769Peak heightReduction no
MS positive ion modecitric acid1816Peak heightLumA no
MS positive ion modecitric acid1816Peak heightReduction no
MS positive ion modecitric acid1943Peak heightDCIS no
MS positive ion modecitric acid2209Peak heightDCIS no
MS positive ion modecitric acid2373Peak heightDCIS no
MS positive ion modecitric acid2677Peak heightReduction no
MS positive ion modecitric acid3230Peak heightReduction no
MS positive ion modecitric acid3759Peak heightLumA no
MS positive ion modecitric acid4229Peak heightBasal no
MS positive ion modecitric acid4229Peak heightLumB no
MS positive ion modecitric acid4301Peak heightLumA no
MS positive ion modecitric acid4383Peak heightDCIS no
MS positive ion modecitric acid4951Peak heightLumA no
MS positive ion modecitric acid5046Peak heightLumA no
MS positive ion modecitric acid5307Peak heightReduction no
MS positive ion modecitric acid5644Peak heightReduction no
MS positive ion modecitric acid5986Peak heightDCIS no
MS positive ion modecitric acid6610Peak heightReduction yes
MS positive ion modecitric acid6910Peak heightReduction no
MS positive ion modecitric acid6913Peak heightReduction no
MS positive ion modecitric acid7422Peak heightBasal no
MS positive ion modecitric acid7590Peak heightHER2 no
MS positive ion modecitric acid7849Peak heightDCIS no
MS positive ion modecitric acid7994Peak heightHER2 no
MS positive ion modecitric acid8199Peak heightLumB no
MS positive ion modecitric acid8409Peak heightHER2 no
MS positive ion modecitric acid8642Peak heightBasal no
MS positive ion modecitric acid8864Peak heightLumB no
MS positive ion modecitric acid9106Peak heightReduction no
MS positive ion modecitric acid9323Peak heightLumA no
MS positive ion modecitric acid9519Peak heightLumA yes
MS positive ion modecitric acid10065Peak heightTotal Pool1 yes
MS positive ion modecitric acid10140Peak heightTotal Pool2 yes
MS positive ion modecitric acid10433Peak heightLumB no
MS positive ion modecitric acid10520Peak heightTotal Pool2 yes
MS positive ion modecitric acid11164Peak heightHER2 no
MS positive ion modecitric acid11575Peak heightDCIS no
MS positive ion modecitric acid11721Peak heightBasal yes
MS positive ion modecitric acid11735Peak heightReduction no
MS positive ion modecitric acid11753Peak heightReduction no
MS positive ion modecitric acid12316Peak heightTotal Pool2 yes
MS positive ion modecitric acid12585Peak heightTotal Pool2 yes
MS positive ion modecitric acid12626Peak heightTotal Pool1 yes
MS positive ion modecitric acid12733Peak heightDCIS no
MS positive ion modecitric acid13024Peak heightBasal no
MS positive ion modecitric acid13047Peak heightTotal Pool1 yes
MS positive ion modecitric acid13164Peak heightTotal Pool2 yes
MS positive ion modecitric acid13301Peak heightLumB yes
MS positive ion modecitric acid13381Peak heightDCIS no
MS positive ion modecitric acid13393Peak heightReduction no
MS positive ion modecitric acid13422Peak heightLumB no
MS positive ion modecitric acid13429Peak heightDCIS no
MS positive ion modecitric acid13451Peak heightLumA no
MS positive ion modecitric acid13789Peak heightHER2 yes
MS positive ion modecitric acid13819Peak heightTotal Pool2 yes
MS positive ion modecitric acid13930Peak heightTotal Pool2 yes
MS positive ion modecitric acid13965Peak heightLumB no
MS positive ion modecitric acid13985Peak heightLumA no
MS positive ion modecitric acid14074Peak heightLumB no
MS positive ion modecitric acid14405Peak heightReduction no
MS positive ion modecitric acid14970Peak heightLumA no
MS positive ion modecitric acid15130Peak heightHER2 yes
MS positive ion modecitric acid15273Peak heightLumA no
MS positive ion modecitric acid15330Peak heightTotal Pool2 yes
MS positive ion modecitric acid15397Peak heightBasal yes
MS positive ion modecitric acid15441Peak heightTotal Pool1 yes
MS positive ion modecitric acid16023Peak heightHER2 no
MS positive ion modecitric acid16124Peak heightBasal no
MS positive ion modecitric acid16445Peak heightLumA no
MS positive ion modecitric acid16958Peak heightTotal Pool2 yes
MS positive ion modecitric acid17008Peak heightReduction no
MS positive ion modecitric acid17120Peak heightTotal Pool2 yes
MS positive ion modecitric acid17150Peak heightBasal no
MS positive ion modecitric acid17701Peak heightTotal Pool1 yes
MS positive ion modecitric acid18323Peak heightBasal no
MS positive ion modecitric acid18636Peak heightTotal Pool1 yes
MS positive ion modecitric acid19594Peak heightReduction yes
MS positive ion modecitric acid20219Peak heightLumA no
MS positive ion modecitric acid20253Peak heightLumB no
MS positive ion modecitric acid20926Peak heightDCIS no
MS positive ion modecitric acid20932Peak heightTotal Pool2 yes
MS positive ion modecitric acid21543Peak heightLumB no
MS positive ion modecitric acid21834Peak heightReduction no
MS positive ion modecitric acid22414Peak heightLumB no
MS positive ion modecitric acid22603Peak heightLumA no
MS positive ion modecitric acid23063Peak heightTotal Pool1 yes
MS positive ion modecitric acid23510Peak heightTotal Pool1 yes
MS positive ion modecitric acid23542Peak heightReduction yes
MS positive ion modecitric acid23654Peak heightLumA no
MS positive ion modecitric acid23720Peak heightBasal no
MS positive ion modecitric acid24248Peak heightHER2 yes
MS positive ion modecitric acid24649Peak heightBasal no
MS positive ion modecitric acid24795Peak heightDCIS no
MS positive ion modecitric acid25045Peak heightHER2 no
MS positive ion modecitric acid25299Peak heightBasal no
MS positive ion modecitric acid25457Peak heightBasal no
MS positive ion modecitric acid25525Peak heightHER2 no
MS positive ion modecitric acid25882Peak heightBasal no
MS positive ion modecitric acid25944Peak heightTotal Pool2 yes
MS positive ion modecitric acid25969Peak heightLumB yes
MS positive ion modecitric acid26358Peak heightBasal no
MS positive ion modecitric acid26551Peak heightLumB no
MS positive ion modecitric acid27111Peak heightTotal Pool1 yes
MS positive ion modecitric acid27204Peak heightTotal Pool2 yes
MS positive ion modecitric acid27345Peak heightDCIS no
MS positive ion modecitric acid27633Peak heightTotal Pool1 yes
MS positive ion modecitric acid27709Peak heightHER2 no
MS positive ion modecitric acid27851Peak heightLumA yes
MS positive ion modecitric acid28471Peak heightReduction no
MS positive ion modecitric acid28660Peak heightHER2 yes
MS positive ion modecitric acid28995Peak heightTotal Pool1 yes
MS positive ion modecitric acid29027Peak heightTotal Pool2 yes
MS positive ion modecitric acid29091Peak heightBasal no
MS positive ion modecitric acid29116Peak heightDCIS no
MS positive ion modecitric acid29467Peak heightHER2 no
MS positive ion modecitric acid29701Peak heightTotal Pool1 yes
MS positive ion modecitric acid29889Peak heightLumA yes
MS positive ion modecitric acid30409Peak heightReduction yes
MS positive ion modecitric acid30678Peak heightTotal Pool1 yes
MS positive ion modecitric acid31051Peak heightLumA no
MS positive ion modecitric acid31184Peak heightTotal Pool1 yes
MS positive ion modecitric acid31670Peak heightTotal Pool1 yes
MS positive ion modecitric acid32172Peak heightDCIS yes
MS positive ion modecitric acid32228Peak heightBasal no
MS positive ion modecitric acid32793Peak heightTotal Pool1 yes
MS positive ion modecitric acid32821Peak heightHER2 no
MS positive ion modecitric acid32974Peak heightReduction no
MS positive ion modecitric acid33401Peak heightTotal Pool1 yes
MS positive ion modecitric acid33428Peak heightBasal no
MS positive ion modecitric acid34233Peak heightTotal Pool1 yes
MS positive ion modecitric acid34464Peak heightTotal Pool1 yes
MS positive ion modecitric acid34822Peak heightTotal Pool1 yes
MS positive ion modecitric acid36489Peak heightBasal no
MS positive ion modecitric acid36583Peak heightHER2 no
MS positive ion modecitric acid37193Peak heightTotal Pool1 yes
MS positive ion modecitric acid37294Peak heightHER2 no
MS positive ion modecitric acid38018Peak heightReduction no
MS positive ion modecitric acid39791Peak heightLumA no
MS positive ion modecitric acid40005Peak heightDCIS yes
MS positive ion modecitric acid40275Peak heightDCIS no
MS positive ion modecitric acid40833Peak heightLumA no
MS positive ion modecitric acid41216Peak heightLumA no
MS positive ion modecitric acid41411Peak heightLumB no
MS positive ion modecitric acid42255Peak heightTotal Pool1 yes
MS positive ion modecitric acid43692Peak heightLumB no
MS positive ion modecitric acid43996Peak heightLumB yes
MS positive ion modecitric acid44169Peak heightDCIS no
MS positive ion modecitric acid44175Peak heightLumA no
MS positive ion modecitric acid44762Peak heightTotal Pool1 yes
MS positive ion modecitric acid45095Peak heightBasal no
MS positive ion modecitric acid45406Peak heightLumB no
MS positive ion modecitric acid45433Peak heightLumA no
MS positive ion modecitric acid45919Peak heightTotal Pool1 yes
MS positive ion modecitric acid48071Peak heightBasal yes
MS positive ion modecitric acid49390Peak heightBasal no
MS positive ion modecitric acid51040Peak heightDCIS yes
MS positive ion modecitric acid52829Peak heightBasal yes
MS positive ion modecitric acid52837Peak heightTotal Pool1 yes
MS positive ion modecitric acid53445Peak heightTotal Pool1 yes
MS positive ion modecitric acid55107Peak heightLumB yes
MS positive ion modecitric acid55811Peak heightLumB no
MS positive ion modecitric acid57640Peak heightDCIS yes
MS positive ion modecitric acid60435Peak heightDCIS no
MS positive ion modecitric acid60824Peak heightLumA no
MS positive ion modecitric acid60838Peak heightDCIS no
MS positive ion modecitric acid62458Peak heightHER2 no
MS positive ion modecitric acid62486Peak heightLumA no
MS positive ion modecitric acid64851Peak heightHER2 no
MS positive ion modecitric acid66979Peak heightHER2 no
MS positive ion modecitric acid68397Peak heightDCIS no
MS positive ion modecitric acid74093Peak heightLumB no
MS positive ion modecitric acid76485Peak heightHER2 no
MS positive ion modecitric acid113903Peak heightReduction no
MS positive ion modecitric acid114471Peak heightDCIS no
MS positive ion modecitric acid154595Peak heightBasal no
MS positive ion modecitric acid182244Peak heightBasal no
MS positive ion modecitric acid600776Peak heightLumB no

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