Exact Mass: 250.1205
Exact Mass Matches: 250.1205
Found 227 metabolites which its exact mass value is equals to given mass value 250.1205,
within given mass tolerance error 4.0E-5 dalton. Try search metabolite list with more accurate mass tolerance error
8.0E-6 dalton.
Diisopropylphthalate
CONFIDENCE standard compound; INTERNAL_ID 832; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9433; ORIGINAL_PRECURSOR_SCAN_NO 9428 CONFIDENCE standard compound; INTERNAL_ID 832; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4533; ORIGINAL_PRECURSOR_SCAN_NO 4530 CONFIDENCE standard compound; INTERNAL_ID 832; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9448; ORIGINAL_PRECURSOR_SCAN_NO 9444 CONFIDENCE standard compound; INTERNAL_ID 832; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4512; ORIGINAL_PRECURSOR_SCAN_NO 4510 CONFIDENCE standard compound; INTERNAL_ID 832; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9411; ORIGINAL_PRECURSOR_SCAN_NO 9407 CONFIDENCE standard compound; INTERNAL_ID 832; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9458; ORIGINAL_PRECURSOR_SCAN_NO 9456 CONFIDENCE standard compound; INTERNAL_ID 832; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4596; ORIGINAL_PRECURSOR_SCAN_NO 4593 CONFIDENCE standard compound; INTERNAL_ID 832; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9380; ORIGINAL_PRECURSOR_SCAN_NO 9378 CONFIDENCE standard compound; INTERNAL_ID 832; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4515; ORIGINAL_PRECURSOR_SCAN_NO 4513 CONFIDENCE standard compound; INTERNAL_ID 832; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9407; ORIGINAL_PRECURSOR_SCAN_NO 9402 CONFIDENCE standard compound; INTERNAL_ID 832; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4506; ORIGINAL_PRECURSOR_SCAN_NO 4505 CONFIDENCE standard compound; INTERNAL_ID 832; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4506; ORIGINAL_PRECURSOR_SCAN_NO 4504 CONFIDENCE standard compound; INTERNAL_ID 196
Dipropylphthalate
CONFIDENCE standard compound; INTERNAL_ID 1293; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9488; ORIGINAL_PRECURSOR_SCAN_NO 9483 CONFIDENCE standard compound; INTERNAL_ID 1293; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4235; ORIGINAL_PRECURSOR_SCAN_NO 4230 CONFIDENCE standard compound; INTERNAL_ID 1293; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4278; ORIGINAL_PRECURSOR_SCAN_NO 4277 CONFIDENCE standard compound; INTERNAL_ID 1293; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4579; ORIGINAL_PRECURSOR_SCAN_NO 4575 CONFIDENCE standard compound; INTERNAL_ID 1293; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9470; ORIGINAL_PRECURSOR_SCAN_NO 9468 CONFIDENCE standard compound; INTERNAL_ID 1293; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4253; ORIGINAL_PRECURSOR_SCAN_NO 4251 CONFIDENCE standard compound; INTERNAL_ID 1293; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4271; ORIGINAL_PRECURSOR_SCAN_NO 4270 CONFIDENCE standard compound; INTERNAL_ID 1293; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9411; ORIGINAL_PRECURSOR_SCAN_NO 9407 CONFIDENCE standard compound; INTERNAL_ID 1293; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4287; ORIGINAL_PRECURSOR_SCAN_NO 4286 CONFIDENCE standard compound; INTERNAL_ID 1293; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9460; ORIGINAL_PRECURSOR_SCAN_NO 9457 CONFIDENCE standard compound; INTERNAL_ID 1293; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9433; ORIGINAL_PRECURSOR_SCAN_NO 9428 CONFIDENCE standard compound; INTERNAL_ID 197
Ubiquinone-1
Ubiquinone-1 is a member of the chemical class known as Polyprenylbenzoquinones. These are compounds containing a polyisoprene chain attached to a quinone at the second ring position. Ubiquione-1 has just 1 isoprene unit. Normally in humans it has 10. Ubiquinone-1 is an intermediate in the synthesis of Ubiquionone 10, which is also called Coenzyme Q (CoQ). CoQ is found in the membranes of endoplasmic reticulum, peroxisomes, lysosomes, vesicles and notably the inner membrane of the mitochondrion where it is an important part of the electron transport chain; there it passes reducing equivalents to acceptors such as Coenzyme Q : cytochrome c - oxidoreductase. CoQ is also essential in the formation of the apoptosome along with other adapter proteins. The loss of trophic factors activates pro-apoptotic enzymes, causing the breakdown of mitochondria. Because of its ability to transfer electrons and therefore act as an antioxidant, Coenzyme Q has become a valued dietary supplement. CoQ10 has been widely used for the treatment of heart disease (especially heart failure), gum diseases, and also breast cancer. The benzoquinone portion of Coenzyme Q10 is synthesized from amino acids, while the isoprene sidechain is synthesized from acetyl CoA through the mevalonate pathway. The mevalonate pathway is used for the first steps of cholesterol biosynthesis. A compound composed of the standard 2,3-dimethoxy-5-methylbenzoquinone nucleus common to ubiquinones; and a side chain of a single isoprenoid unit. [ChEBI] COVID info from COVID-19 Disease Map Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS
3,4-Dihydro-6-hydroxy-2,5,7,8-tetramethyl-2H-1-benzopyran-2-carboxylic acid
3,4-Dihydro-6-hydroxy-2,5,7,8-tetramethyl-2H-1-benzopyran-2-carboxylic acid is an antioxidant used in food industry. D020011 - Protective Agents > D000975 - Antioxidants Antioxidant used in food industry
Helinorbisabone
Helinorbisabone is found in fats and oils. Helinorbisabone is a constituent of Helianthus annuus (sunflower) Constituent of Helianthus annuus (sunflower). Helinorbisabone is found in fats and oils.
Methyl neopentyl phthalic acid
Methyl neopentyl phthalic acid, also known as phthalic acid, methyl neopentyl ester, is classified as a member of the benzoic acid esters. Benzoic acid esters are ester derivatives of benzoic acid. Methyl neopentyl phthalic acid is considered to be practically insoluble (in water) and basic. (ChemoSummarizer)
Delta-CEHC
delta-CEHC, also known as δ-cehc, belongs to the class of organic compounds known as 1-benzopyrans. These are organic aromatic compounds that 1-benzopyran, a bicyclic compound made up of a benzene ring fused to a pyran, so that the oxygen atom is at the 1-position. Based on a literature review very few articles have been published on delta-CEHC.
2-[4-(2-Carboxy-2-methylpropyl)phenyl]propionic acid
Isobutyric acid 2-methoxy-4-(1-hydroxy-2-propenyl)phenyl ester
2,4,6-Trihydroxy-propiophenon-4-O-3,3-dimethylallylether
4-Methoxy-2-(3-methyloxiranyl)phenyl 2-methylpropanoate
dihydropyriculol
A member of the class of benzyl alcohols resulting from the formal reduction of the aldehyde group of pyriculol. Produced by the rice blast fungus Magnaporthe oryzae.
(4aS,5R,6S)-6-(acetyloxy)-5,6,7,8-tetrahydro-3-hydroxy-4a,5-dimethylnaphthalen-2(4aH)-one|3beta-(acetyloxy)-7-hydroxynoreremophila-6,9-dien-8-one
(+/-)-vertinolide|(-)-4-hydroxy-3,5-dimethyl-5-(3-oxo-(E,E)-4,6-octadienyl)-2(5H)-furanone|4-hydroxy-3,5-dimethyl-5-((E)-3-oxoocta-4,6-dienyl)furan-2(5H)-one|vertinolide
3-acetyl-5-<(1E,3E)-hexa-1,3-dienyl>-4-methoxy-5-methylfuran-2(5H)-one|3-acetyl-5-[(1E,3E)-hexa-1,3-dienyl]-4-methoxy-5-methyl-2(5H)-furanone|iso-gregatin B|Isogregatin B
2,4-Dihydroxy-3-(3-methyl-2-butenyl)-6-methylbenzoic acid methyl ester
(3S,3aR,4S,6aR,9aS,9bR)-4-hydroxy-3-methyl-6-methyleneoctahydroazuleno[4,5-b]furan-2,8(3H,9bH)-dione|15-nor-guaianolide
2-Hydroxy-3-methoxy-4-methyl-5-(3-methyl-2-butenyl)benzoic acid
(S)-1-methylbutyl caffeate
An alkyl caffeate ester obtained by the formal condensation of trans-caffeic acid with 2-pentanol. Isolated from the leaves of Piper sanguineispicum, it has been shown to exhibit antileishmanial activity.
1-(2-methoxy-4-hydroxy-5-acetylphenyl)-3-methylbutan-1-one
1,2-4,5-tetrahydro-11-nor-11-hydroxy-Delta7,11-santonin
1,4-diacetoxy-2-isopropyl-5-methyl-benzene|1,4-Diacetoxy-2-isopropyl-5-methyl-benzol|2,5-diacetylthymol|2-hydroxythymol diacetate|2.5-Diacetoxy-p-cymol|Thymochinol-diacetat|Thymohydrochinon-diacetat
11-hydroxy-4alpha,5alpha-epoxy-1alphaH,10alphaH-13-norguai-7(11)-en-12,8alpha-olide
1-(2-hydroxy-4-methoxy-5-hydroxymethylphenyl)-E-4-hexen-1-one
1-(5-acetyl-2-hydroxy-4-methoxyphenyl)-3-methylbutan-1-one
(1S,3R)-3-hydroxy-1-methylbutyl (2E)-3-(4-hydroxyphenyl)prop-2-enoate
5,6,7-trimethoxy-2,2-dimethyl-2H-chromene|Methyl-evodionol
3-(2-Hydroxy-3-methyl-3-butenyl)-4-hydroxybenzoic acid ethyl ester
8-hydroxy-3-(4-hydroxypentyl)-3,4-dihydroisochromen-1-one
2-(2-carboxy-2-methylpropyl)-4,6-dimethylbenzoic acid
Benzenemethanol,2,3-dimethoxy-a-2-propen-1-yl-, 1-acetate
1-[2-HYDROXY-4-(OXIRAN-2-YLMETHOXY)-3-PROPYLPHENYL]ETHAN-1-ONE
3,5-dimethyl-2-[(2-methylpropan-2-yl)oxycarbonyl]benzoic acid
1-(3,4-dimethoxyphenyl)cyclopentane-1-carboxylic acid
(R)-2-acetyl-2-hydroxy-5,8-dimethoxy-1,2,3,4-tetrahydronaphthalene
3,5-Dimethoxy-4-[(3-methylbut-2-en-1-yl)oxy]benzaldehyde
3-(4-Hydroxypentyl)-8-hydroxy-3,4-dihydro-1H-2-benzopyran-1-one
Westerdijkin A
A methyl ester resulting from the formal condensation of the the carboxy group of {4-[(2-hydroxy-3-methylbut-3-en-1-yl)oxy]phenyl}acetic acid with methanol. It is a natural product isolated from the culture of the deep sea-derived fungus Aspergillus westerdijkiae SCSIO 05233.
Dihydropyriculariol
A hydroxybenzyl alcohol that is pyriculariol in which the aldehyde goup has been reduced to the corresponding alcohol.
(3Z)-6-(2,5-Dihydroxy-4-methylphenyl)-5-hydroxy-3-hepten-2-one
2-Hydroxy-3-[4-hydroxy-3-(3-methylbut-2-enyl)phenyl]propanoic acid
Ubiquinone-1
A compound composed of the standard 2,3-dimethoxy-5-methylbenzoquinone nucleus common to ubiquinones; and a side chain of a single isoprenoid unit. COVID info from COVID-19 Disease Map Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS
6-hydroxy-8a-methyl-3-methylidene-octahydronaphtho[2,3-b]furan-2,5-dione
(2'r,5s,6s)-5-hydroxy-2'-(2-hydroxypropan-2-yl)-2-methyl-4,5-dihydrospiro[1-benzofuran-6,1'-cyclopropan]-7-one
(2s)-2-hydroxy-4-methyl-2-[(1s)-1,2,2-trimethyl-4-oxocyclopentyl]cyclopent-4-ene-1,3-dione
6-[1-(2,3-dimethyloxiran-2-yl)prop-1-en-2-yl]-4-methoxy-3-methylpyran-2-one
6-[(1z)-1-[(2s,3s)-2,3-dimethyloxiran-2-yl]prop-1-en-2-yl]-4-methoxy-3-methylpyran-2-one
ethyl 4-hydroxy-3-[(2r)-2-hydroxy-3-methylbut-3-en-1-yl]benzoate
(2s)-7-hydroxy-2-(3-hydroxypropyl)-6,8-dimethyl-2,3-dihydro-1-benzopyran-4-one
5-hydroxy-2'-(2-hydroxypropan-2-yl)-2-methyl-4,5-dihydrospiro[1-benzofuran-6,1'-cyclopropan]-7-one
(3r)-10,12-dihydroxy-3-methyl-3,4,5,6,7,8-hexahydro-2-benzoxecin-1-one
3a-hydroxy-2-(2-hydroxypropan-2-yl)-5-(prop-2-en-1-yl)-2,3-dihydro-1-benzofuran-6-one
(2s,3s)-6-[(1r)-1,2-dihydroxyethyl]-3-hydroxy-2,5,7-trimethyl-2,3-dihydroinden-1-one
1-{2,6-dihydroxy-4-[(3-methylbut-2-en-1-yl)oxy]phenyl}propan-1-one
(1e,3s,4s,5e)-1-[3-hydroxy-2-(hydroxymethyl)phenyl]hepta-1,5-diene-3,4-diol
2-hydroxy-3-methoxy-4-methyl-5-(3-methylbut-2-en-1-yl)benzoic acid
4-hydroxy-9,13-dimethyl-6,14-dioxatetracyclo[8.4.0.0¹,¹³.0³,⁷]tetradec-3-en-5-one
[(2r)-2-(2-hydroxy-4-methylphenyl)oxiran-2-yl]methyl 2-methylpropanoate
2,3-dimethoxy-6-(2-methylprop-1-en-1-yl)phenyl acetate
2,7-diethyl-2,3,8-trihydroxy-3,4-dihydronaphthalen-1-one
(2R,3S)- pterosin Q
{"Ingredient_id": "HBIN006502","Ingredient_name": "(2R,3S)- pterosin Q","Alias": "NA","Ingredient_formula": "C14H18O4","Ingredient_Smile": "CC1C(C2=CC(=C(C(=C2C1=O)C)C(CO)O)C)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "41785","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
(2R,3S)- pterosin S
{"Ingredient_id": "HBIN006503","Ingredient_name": "(2R,3S)- pterosin S","Alias": "NA","Ingredient_formula": "C14H18O4","Ingredient_Smile": "CC1C(C2=CC(=C(C(=C2C1=O)CO)CCO)C)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "41786","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
