Source Name Characteristics[sample_name] Characteristics[organism] Characteristics[taxonomy_id] Characteristics[collection_date] Characteristics[isolate] Characteristics[sex] Characteristics[tissue] Comment[BioSample] Comment[sample_title] Protocol REF Sample Name Protocol REF Parameter Value[Post extraction] Parameter Value[Derivatization] Extract Name Protocol REF Parameter Value[Chromatography instrument] Parameter Value[Autosampler model] Parameter Value[Column model] Parameter Value[Column type] Parameter Value[Guard column] Labeled Extract Name Label Protocol REF Parameter Value[Scan polarity] Parameter Value[Scan m/z range] Parameter Value[Instrument] Parameter Value[Ion source] Parameter Value[Mass analyzer] Assay Name Comment[technical_replicate] Raw Data File Raw Data File Protocol REF Processed Data File Protocol REF Metabolite Assignment File Comment[maf_value_unit] Factor Value[tissue] King food (colony MT552) KF_MT552 Reticulitermes speratus 60591 2020-09-16 KF_MT552 King food SAMD00532486 King food (colony MT552) Sample collection KF_MT552_Pe Extraction KF_MT552_Pe Chromatography Easy-nLC 100 (Thermofisher Scientific) NTCC-360 C18 column (0.075 mm i.d. x 125 mm, 3 micrometre, Nikkyo Technos) reverse phase Mass spectrometry positive 350-1800 Q-Exactive (quadrupole-Orbitrap MS, Thermofisher Scientific) electrospray ionization quadrupole orbitrap KF_MT552_Pe raw/20210121_RF_D001_18ul_65min.raw raw/20210121_RF_D001_18ul_65min.mzML Data processing processed/Spectra_List_MS1-RF6_To_PK.txt Metabolite identification King food King food (colony MT548) KF_MT548 Reticulitermes speratus 60591 2020-09-30 KF_MT548 King food SAMD00532487 King food (colony MT548) Sample collection KF_MT548_Pe Extraction KF_MT548_Pe Chromatography Easy-nLC 100 (Thermofisher Scientific) NTCC-360 C18 column (0.075 mm i.d. x 125 mm, 3 micrometre, Nikkyo Technos) reverse phase Mass spectrometry positive 350-1800 Q-Exactive (quadrupole-Orbitrap MS, Thermofisher Scientific) electrospray ionization quadrupole orbitrap KF_MT548_Pe raw/20210121_RF_D021_18ul_65min.raw raw/20210121_RF_D021_18ul_65min.mzML Data processing processed/Spectra_List_MS1-RF7_To_PK.txt Metabolite identification King food Queen food (colony MT552) QF_MT552 Reticulitermes speratus 60591 2020-09-16 QF_MT552 Queen food SAMD00532488 Queen food (colony MT552) Sample collection QF_MT552_Pe Extraction QF_MT552_Pe Chromatography Easy-nLC 100 (Thermofisher Scientific) NTCC-360 C18 column (0.075 mm i.d. x 125 mm, 3 micrometre, Nikkyo Technos) reverse phase Mass spectrometry positive 350-1800 Q-Exactive (quadrupole-Orbitrap MS, Thermofisher Scientific) electrospray ionization quadrupole orbitrap QF_MT552_Pe raw/20210121_RF_D002_18ul_65min.raw raw/20210121_RF_D002_18ul_65min.mzML Data processing processed/Spectra_List_MS1-RF6_To_SQ.txt Metabolite identification Queen food Queen food (colony MT548) QF_MT548 Reticulitermes speratus 60591 2020-09-30 QF_MT548 Queen food SAMD00532489 Queen food (colony MT548) Sample collection QF_MT548_Pe Extraction QF_MT548_Pe Chromatography Easy-nLC 100 (Thermofisher Scientific) NTCC-360 C18 column (0.075 mm i.d. x 125 mm, 3 micrometre, Nikkyo Technos) reverse phase Mass spectrometry positive 350-1800 Q-Exactive (quadrupole-Orbitrap MS, Thermofisher Scientific) electrospray ionization quadrupole orbitrap QF_MT548_Pe raw/20210121_RF_D022_18ul_65min.raw raw/20210121_RF_D022_18ul_65min.mzML Data processing processed/Spectra_List_MS1-RF7_To_SQ.txt Metabolite identification Queen food Primary king midgut content (colony MT552) PKMC_MT552 Reticulitermes speratus 60591 2020-09-23 PKMC_MT552 male Primary king midgut content SAMD00532506 Primary king midgut content (colony MT552) Sample collection PKMC_MT552_Pe Extraction PKMC_MT552_Pe Chromatography Easy-nLC 100 (Thermofisher Scientific) NTCC-360 C18 column (0.075 mm i.d. x 125 mm, 3 micrometre, Nikkyo Technos) reverse phase Mass spectrometry positive 350-1800 Q-Exactive (quadrupole-Orbitrap MS, Thermofisher Scientific) electrospray ionization quadrupole orbitrap PKMC_MT552_Pe raw/20210118_PK6_RF_10ul_65min.raw raw/20210118_PK6_RF_10ul_65min.mzML Data processing processed/Spectra_list_MS1-Midgut6_PK.txt Metabolite identification Primary king midgut content Primary king midgut content (colony MT548) PKMC_MT548 Reticulitermes speratus 60591 2020-10-02 PKMC_MT548 male Primary king midgut content SAMD00532507 Primary king midgut content (colony MT548) Sample collection PKMC_MT548_Pe Extraction PKMC_MT548_Pe Chromatography Easy-nLC 100 (Thermofisher Scientific) NTCC-360 C18 column (0.075 mm i.d. x 125 mm, 3 micrometre, Nikkyo Technos) reverse phase Mass spectrometry positive 350-1800 Q-Exactive (quadrupole-Orbitrap MS, Thermofisher Scientific) electrospray ionization quadrupole orbitrap PKMC_MT548_Pe raw/20210118_PK7_RF_10ul_65min.raw raw/20210118_PK7_RF_10ul_65min.mzML Data processing processed/Spectra_list_MS1-Midgut7_PK.txt Metabolite identification Primary king midgut content Secondary queen midgut content (colony MT552) SQMC_MT552 Reticulitermes speratus 60591 2020-09-23 SQMC_MT552 female Secondary queen midgut content SAMD00532508 Secondary queen midgut content (colony MT552) Sample collection SQMC_MT552_Pe Extraction SQMC_MT552_Pe Chromatography Easy-nLC 100 (Thermofisher Scientific) NTCC-360 C18 column (0.075 mm i.d. x 125 mm, 3 micrometre, Nikkyo Technos) reverse phase Mass spectrometry positive 350-1800 Q-Exactive (quadrupole-Orbitrap MS, Thermofisher Scientific) electrospray ionization quadrupole orbitrap SQMC_MT552_Pe raw/20210118_SQ6_RF_10ul_65min.raw raw/20210118_SQ6_RF_10ul_65min.mzML Data processing processed/Spectra_list_MS1-Midgut6_SQ.txt Metabolite identification Secondary queen midgut content Secondary queen midgut content (colony MT548) SQMC_MT548 Reticulitermes speratus 60591 2020-10-02 SQMC_MT548 female Secondary queen midgut content SAMD00532509 Secondary queen midgut content (colony MT548) Sample collection SQMC_MT548_Pe Extraction SQMC_MT548_Pe Chromatography Easy-nLC 100 (Thermofisher Scientific) NTCC-360 C18 column (0.075 mm i.d. x 125 mm, 3 micrometre, Nikkyo Technos) reverse phase Mass spectrometry positive 350-1800 Q-Exactive (quadrupole-Orbitrap MS, Thermofisher Scientific) electrospray ionization quadrupole orbitrap SQMC_MT548_Pe raw/20210118_SQ7_RF_10ul_65min.raw raw/20210118_SQ7_RF_10ul_65min.mzML Data processing processed/Spectra_list_MS1-Midgut7_SQ.txt Metabolite identification Secondary queen midgut content Soldier midgut content (colony MT552) SMC_MT552 Reticulitermes speratus 60591 2020-09-23 SMC_MT552 Soldier midgut content SAMD00532510 Soldier midgut content (colony MT552) Sample collection SMC_MT552_Pe Extraction SMC_MT552_Pe Chromatography Easy-nLC 100 (Thermofisher Scientific) NTCC-360 C18 column (0.075 mm i.d. x 125 mm, 3 micrometre, Nikkyo Technos) reverse phase Mass spectrometry positive 350-1800 Q-Exactive (quadrupole-Orbitrap MS, Thermofisher Scientific) electrospray ionization quadrupole orbitrap SMC_MT552_Pe raw/20210118_Sol6_F_10ul_65min.raw raw/20210118_Sol6_F_10ul_65min.mzML Data processing processed/Spectra_list_MS1-Midgut6_Sol.txt Metabolite identification Soldier midgut content Soldier midgut content (colony MT548) SMC_MT548 Reticulitermes speratus 60591 2020-10-02 SMC_MT548 Soldier midgut content SAMD00532511 Soldier midgut content (colony MT548) Sample collection SMC_MT548_Pe Extraction SMC_MT548_Pe Chromatography Easy-nLC 100 (Thermofisher Scientific) NTCC-360 C18 column (0.075 mm i.d. x 125 mm, 3 micrometre, Nikkyo Technos) reverse phase Mass spectrometry positive 350-1800 Q-Exactive (quadrupole-Orbitrap MS, Thermofisher Scientific) electrospray ionization quadrupole orbitrap SMC_MT548_Pe raw/20210118_Sol7_F_10ul_65min.raw raw/20210118_Sol7_F_10ul_65min.mzML Data processing processed/Spectra_list_MS1-Midgut7_Sol.txt Metabolite identification Soldier midgut content Worker midgut content (colony MT552) WMC_MT552 Reticulitermes speratus 60591 2020-09-23 WMC_MT552 Worker midgut content SAMD00532512 Worker midgut content (colony MT552) Sample collection WMC_MT552_Pe Extraction WMC_MT552_Pe Chromatography Easy-nLC 100 (Thermofisher Scientific) NTCC-360 C18 column (0.075 mm i.d. x 125 mm, 3 micrometre, Nikkyo Technos) reverse phase Mass spectrometry positive 350-1800 Q-Exactive (quadrupole-Orbitrap MS, Thermofisher Scientific) electrospray ionization quadrupole orbitrap WMC_MT552_Pe raw/20210118_W6_F_10ul_65min.raw raw/20210118_W6_F_10ul_65min.mzML Data processing processed/Spectra_list_MS1-Midgut6_W.txt Metabolite identification Worker midgut content Worker midgut content (colony MT548) WMC_MT548 Reticulitermes speratus 60591 2020-10-02 WMC_MT548 Worker midgut content SAMD00532513 Worker midgut content (colony MT548) Sample collection WMC_MT548_Pe Extraction WMC_MT548_Pe Chromatography Easy-nLC 100 (Thermofisher Scientific) NTCC-360 C18 column (0.075 mm i.d. x 125 mm, 3 micrometre, Nikkyo Technos) reverse phase Mass spectrometry positive 350-1800 Q-Exactive (quadrupole-Orbitrap MS, Thermofisher Scientific) electrospray ionization quadrupole orbitrap WMC_MT548_Pe raw/20210118_W7_F_10ul_65min.raw raw/20210118_W7_F_10ul_65min.mzML Data processing processed/Spectra_list_MS1-Midgut7_W.txt Metabolite identification Worker midgut content