Exact Mass: 448.2209
Exact Mass Matches: 448.2209
Found 337 metabolites which its exact mass value is equals to given mass value 448.2209
,
within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error
0.001 dalton.
Atractyloside
Atractyloside A is a terpene glycoside. Atractyloside A is a natural product found in Atractylodes japonica, Atractylodes macrocephala, and Atractylodes lancea with data available. Atractyloside A is a natural TCM reference compound. Atractyloside A is a natural TCM reference compound.
Neryl arabinofuranosyl-glucoside
Neryl arabinofuranosyl-glucoside is found in alcoholic beverages. Neryl arabinofuranosyl-glucoside is isolated from wine grapes (Vitis vinifera Isolated from wine grapes (Vitis vinifera). Neryl arabinofuranosyl-glucoside is found in alcoholic beverages, fruits, and common grape.
Acuminoside
Constituent of damask rose (Rosa damascena) and wine grapes (Vitis vinifera). Geranyl apiosyl-glucoside is found in many foods, some of which are green vegetables, alcoholic beverages, herbs and spices, and fruits. Acuminoside is found in alcoholic beverages. Acuminoside is a constituent of damask rose (Rosa damascena) and wine grapes (Vitis vinifera)
Geranyl arabinopyranosyl-glucoside
Geranyl arabinopyranosyl-glucoside is found in green vegetables. Geranyl arabinopyranosyl-glucoside is a constituent of Chinese raisin tree leaves and damask rose (Rosa damascena var. bulgaria). Constituent of tea (Camellia sinensis) leaves. Geranyl xylosyl-glucoside is found in tea.
L-Linalool 3-[xylosyl-(1->6)-glucoside]
L-Linalool 3-[xylosyl-(1->6)-glucoside] is found in tea. L-Linalool 3-[xylosyl-(1->6)-glucoside] is an aroma precursor from tea (Camellia sinensis var. sinensis). Aroma precursor from tea (Camellia sinensis variety sinensis). L-Linalool 3-[xylosyl-(1->6)-glucoside] is found in tea.
Kenposide B
Kenposide B is found in fruits. Kenposide B is a constituent of Hovenia dulcis (raisin tree). Constituent of Hovenia dulcis (raisin tree). Kenposide B is found in fruits.
Gepotidacin
(6,6-Dimethylbicyclo[3.1.1]hept-2-yl)methyl 6-O-[(2R,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)tetrahydro-2-furanyl]-β-D-glucopyranoside
bornyl 6-O-beta-D-xylopyranosyl-beta-D-glucopyranoside
(4S)-alpha-terpineol O-beta-D-apiofuranosyl-(1->6)-beta-D-glucopyranoside|(4S)-??-Terpineol O-??-D-Apiofuranosyl-(1鈥樏傗垎6)-??-D-glucopyranoside
1,3,7-trihydroxy-2-(3-methyl-2-butenyl)-4-(3,7-dimethyl-2,6-octadienyl)xanthone|cochinchinone A
2-geranyl-1,3,7-trihydroxy-4-(3,3-dimethylallyl)-xanthone|2-geranyl-1,3,7-trihydroxy-4-(3-methylbut-2-enyl)xanthone|2-Geranyl-1,3,7-trihydroxy-4-prenylxanthone
hemerocalloside|[4-methyl-1-(1-methylethyl)cyclohex-3-en-1-yl] 6-O-L-apio-beta-D-furanosyl-beta-D-glucopyranoside
Bornyl 7-O-alpha-L-arabinofuranosyl-(1->6)-beta-D-glucopyranoside
Atractyloside A
Atractyloside A is a natural TCM reference compound. Atractyloside A is a natural TCM reference compound.
(R)-linalyl-6-O-alpha-L-arabinofuranosyl-beta-D-glucopyranoside|(S)-(+)-Linalool O-alpha-L-arabinofuranosyl-(1->6)-beta-D-glucopyranoside
Borneol 7-O-[beta-D-apiofuranosyl-(1->6)]-beta-D-glucopyranoside
(4xi)-alpha-terpineol 8-O-[alpha-L-arabinopyranosyl-(1->6)-beta-D-glucopyranoside]|1-methyl-1-(4-methylcyclohex-3-en-1-yl)ethyl 6-O-alpha-L-arabinopyranosyl-beta-D-glucopyranoside
3-dimethyl-2-geranyl-4-prenylbellidifolin|4-prenyl-2-(3,7-dimethyl-2,6-octadienyl)-1,3,5,8-tetrahydroxyxanthone
1,3,7-trihydroxy-2-prenyl-8-geranylxanthone|pruniflorone P
1-O-isovaleroxyl-11-O-beta-D-glucopyranosyl jatamanin J|patrinovalerosidate
linalyl 6-O-beta-D-apiofuranosyl-beta-D-glucopyranoside
(E)-3-{4-hydroxy-3-[(E)-4-(2,3-dihydrocinnamoyloxy)-3-methyl-2-butenyl]-5-prenylphenyl}-2-propenoic acid
1,7-dihydroxy-2-prenyl-3-geranyloxyxanthone|pruniflorone S
Ile Ser Thr Glu
Thr Ile Ser Glu
C21H36O10_beta-D-Glucopyranoside, (1R)-1-ethenyl-1,5-dimethyl-4-hexen-1-yl 6-O-alpha-L-arabinopyranosyl
C21H36O10_(6,6-Dimethylbicyclo[3.1.1]hept-2-yl)methyl 6-O-[(2R,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)tetrahydro-2-furanyl]-beta-D-glucopyranoside
C21H36O10_(2E)-3,7-Dimethyl-2,6-octadien-1-yl 6-O-[(2R,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)tetrahydro-2-furanyl]-beta-D-glucopyranoside
C21H36O10_(2E)-3,7-Dimethyl-2,6-octadien-1-yl 6-O-alpha-L-arabinofuranosyl-beta-D-glucopyranoside
C25H28N4O4_3-[(2-Benzyl-9-hydroxy-3-oxo-2,3,9,9a-tetrahydro-1H-imidazo[1,2-a]indol-9-yl)methyl]-6-isopropyl-2,5-piperazinedione
(2R,3S,4S,5R,6R)-2-[[(2R,3R,4R,5S)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxymethyl]-6-[(2E)-3,7-dimethylocta-2,6-dienoxy]oxane-3,4,5-triol
(2R,3S,4S,5R,6R)-2-[[(2R,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxymethyl]-6-[(2E)-3,7-dimethylocta-2,6-dienoxy]oxane-3,4,5-triol
(2R,3S,4S,5R,6R)-2-[[(2R,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxymethyl]-6-[(2E)-3,7-dimethylocta-2,6-dienoxy]oxane-3,4,5-triol_major
(2R,3S,4S,5R,6R)-2-[[(2R,3R,4R,5S)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxymethyl]-6-[(2E)-3,7-dimethylocta-2,6-dienoxy]oxane-3,4,5-triol_major
Asp Ile Thr Thr
Asp Leu Thr Thr
Asp Thr Ile Thr
Asp Thr Leu Thr
Asp Thr Thr Ile
Asp Thr Thr Leu
Glu Ile Ser Thr
Glu Ile Thr Ser
Glu Leu Ser Thr
Glu Leu Thr Ser
Glu Ser Ile Thr
Glu Ser Leu Thr
Glu Ser Thr Ile
Glu Ser Thr Leu
Glu Thr Ile Ser
Glu Thr Leu Ser
Glu Thr Ser Ile
Glu Thr Ser Leu
Glu Thr Thr Val
Glu Thr Val Thr
Glu Val Thr Thr
Gly His His Val
Gly His Val His
Gly Val His His
His Gly His Val
His Gly Val His
His His Gly Val
His His Val Gly
His Val Gly His
His Val His Gly
Ile Asp Thr Thr
Ile Glu Ser Thr
Ile Glu Thr Ser
Ile Ser Glu Thr
Ile Thr Asp Thr
Ile Thr Glu Ser
Ile Thr Ser Glu
Ile Thr Thr Asp
Lys Asn Ser Thr
Lys Asn Thr Ser
Lys Gln Ser Ser
Lys Ser Asn Thr
Lys Ser Gln Ser
Lys Ser Ser Gln
Lys Ser Thr Asn
Lys Thr Asn Ser
Lys Thr Ser Asn
Leu Asp Thr Thr
Leu Glu Ser Thr
Leu Glu Thr Ser
Leu Ser Glu Thr
Leu Ser Thr Glu
Leu Thr Asp Thr
Leu Thr Glu Ser
Leu Thr Ser Glu
Leu Thr Thr Asp
Asn Lys Ser Thr
Asn Lys Thr Ser
Asn Ser Lys Thr
Asn Ser Thr Lys
Asn Thr Lys Ser
Asn Thr Ser Lys
Gln Lys Ser Ser
Gln Ser Lys Ser
Gln Ser Ser Lys
Ser Glu Ile Thr
Ser Glu Leu Thr
Ser Glu Thr Ile
Ser Glu Thr Leu
Ser Ile Glu Thr
Ser Ile Thr Glu
Ser Lys Asn Thr
Ser Lys Gln Ser
Ser Lys Ser Gln
Ser Lys Thr Asn
Ser Leu Glu Thr
Ser Leu Thr Glu
Ser Asn Lys Thr
Ser Asn Thr Lys
Ser Gln Lys Ser
Ser Gln Ser Lys
Ser Ser Lys Gln
Ser Ser Gln Lys
Ser Thr Glu Ile
Ser Thr Glu Leu
Ser Thr Ile Glu
Ser Thr Lys Asn
Ser Thr Leu Glu
Ser Thr Asn Lys
Thr Asp Ile Thr
Thr Asp Leu Thr
Thr Asp Thr Ile
Thr Asp Thr Leu
Thr Glu Ile Ser
Thr Glu Leu Ser
Thr Glu Ser Ile
Thr Glu Ser Leu
Thr Glu Thr Val
Thr Glu Val Thr
Thr Ile Asp Thr
Thr Ile Glu Ser
Thr Ile Thr Asp
Thr Lys Asn Ser
Thr Lys Ser Asn
Thr Leu Asp Thr
Thr Leu Glu Ser
Thr Leu Ser Glu
Thr Leu Thr Asp
Thr Asn Lys Ser
Thr Asn Ser Lys
Thr Ser Glu Ile
Thr Ser Glu Leu
Thr Ser Ile Glu
Thr Ser Lys Asn
Thr Ser Leu Glu
Thr Ser Asn Lys
Thr Thr Asp Ile
Thr Thr Asp Leu
Thr Thr Glu Val
Thr Thr Ile Asp
Thr Thr Leu Asp
Thr Thr Val Glu
Thr Val Glu Thr
Thr Val Thr Glu
Val Glu Thr Thr
Val Gly His His
Val His Gly His
Val His His Gly
Val Thr Glu Thr
Val Thr Thr Glu
Acuminoside
Neryl arabinofuranosyl-glucoside
Neohancoside a
Kenposide A
Kenposide B
(2E)-3,7-Dimethyl-2,6-octadien-1-yl 6-O-?-L-arabinofuranosyl-?-D-glucopyranoside
ethyl prop-2-enoate,methyl 2-methylprop-2-enoate,3-trimethoxysilylpropyl 2-methylprop-2-enoate
N,N-BIS(4-METHOXYBENZYLIDENE)-ALPHA,ALPHA-BI-P-TOLUIDINE
Gepotidacin
D000970 - Antineoplastic Agents > D059003 - Topoisomerase Inhibitors C254 - Anti-Infective Agent > C258 - Antibiotic D004791 - Enzyme Inhibitors
2-[[3,4-Dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxymethyl]-6-(3,7-dimethylocta-2,6-dienoxy)oxane-3,4,5-triol
2-[3,8-Dihydroxy-8-(hydroxymethyl)-3-methyl-2-oxodecahydro-5-azulenyl]-2-propanyl hexopyranoside
Geranyl 6-O-beta-D-xylopyranosyl-beta-D-glucopyranoside
Cochinchinone A
A natural product found in Cratoxylum cochinchinense. A member of the class of xanthones that is 9H-xanthen-9-one substituted by hydroxy groups at positions 1, 3 and 7, a prenyl group at position 2 and a geranyl group at position 4. Isolated from Cratoxylum cochinchinense, it exhibits cytotoxic and antioxidant activities.
(2S)-4-methyl-2-[[oxo-[5-[oxo-[(phenylmethyl)amino]methyl]-1H-imidazol-4-yl]methyl]amino]pentanoic acid (phenylmethyl) ester
3,5-dimethyl-4-oxo-6-[(3E,5E,7E,9E)-3,5,7,9-tetramethyl-10-(4-nitrophenyl)deca-3,5,7,9-tetraen-1-yl]-4H-pyran-2-olate
N-[[(2R,4S,5R)-5-[5-(4-luorophenyl)-2-methylpyrazol-3-yl]-1-azabicyclo[2.2.2]octan-2-yl]methyl]-4-methoxybenzamide
(1R,9S,10S,11S)-12-(cyclopropanecarbonyl)-N-(cyclopropylmethyl)-10-(hydroxymethyl)-6-oxo-5-pyridin-3-yl-7,12-diazatricyclo[7.2.1.02,7]dodeca-2,4-diene-11-carboxamide
(1S,9R,10R,11R)-12-(cyclopropanecarbonyl)-N-(cyclopropylmethyl)-10-(hydroxymethyl)-6-oxo-5-pyridin-3-yl-7,12-diazatricyclo[7.2.1.02,7]dodeca-2,4-diene-11-carboxamide
(1S,9R,10R,11R)-N-cyclobutyl-10-(hydroxymethyl)-6-oxo-5-[(E)-prop-1-enyl]-12-(pyridine-2-carbonyl)-7,12-diazatricyclo[7.2.1.02,7]dodeca-2,4-diene-11-carboxamide
(2R,3E,12bS)-3-ethylidene-2-(9H-pyrido[3,4-b]indol-1-ylmethyl)-2,4,6,7,12,12b-hexahydro-1H-indolo[2,3-a]quinolizin-9-ol
(1R,9S,10S,11S)-N-cyclobutyl-10-(hydroxymethyl)-6-oxo-5-[(E)-prop-1-enyl]-12-(pyridine-2-carbonyl)-7,12-diazatricyclo[7.2.1.02,7]dodeca-2,4-diene-11-carboxamide
Geranyl 6-O-alpha-L-arabinofuranosyl-beta-D-glucopyranoside
(1-acetyloxy-3-phosphonooxypropan-2-yl) (9Z,12Z)-hexadeca-9,12-dienoate
BisMePA(16:2)
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(2r,3s,4s,5r,6r)-2-({[(2r,3r,4r,5s)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-6-{[(2e)-3,7-dimethylocta-2,6-dien-1-yl]oxy}oxane-3,4,5-triol
8-(3,7-dimethylocta-2,6-dien-1-yl)-1,3,6-trihydroxy-2-(3-methylbut-2-en-1-yl)xanthen-9-one
(1s,3as,4s,7r,8ar)-1,4-dihydroxy-4-(hydroxymethyl)-1-methyl-7-(2-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}propan-2-yl)-hexahydro-3h-azulen-2-one
(2s,3s,4s,5s,6r)-2-{[5-methyl-2-(prop-1-en-2-yl)hex-4-en-1-yl]oxy}-6-({[(2s,3r,4s,5s)-3,4,5-trihydroxyoxan-2-yl]oxy}methyl)oxane-3,4,5-triol
2-[(2e)-3,7-dimethylocta-2,6-dien-1-yl]-1,3,5-trihydroxy-4-(3-methylbut-2-en-1-yl)xanthen-9-one
15-ethyl-9,17-dihydroxy-11-methyl-7-(4-methyl-5-oxooxolan-2-yl)-13,16-dioxa-6,18-diazapentacyclo[7.6.4.0¹,¹⁹.0⁶,¹⁹.0¹⁰,¹⁴]nonadec-17-en-12-one
(2r,3s,4s,5r,6s)-2-({[(2r,3r,4r)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-6-({2-[(1s)-4-methylcyclohex-3-en-1-yl]propan-2-yl}oxy)oxane-3,4,5-triol
1,4-dihydroxy-4-(hydroxymethyl)-1-methyl-7-(2-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}propan-2-yl)-hexahydro-3h-azulen-2-one
6,8-dihydroxy-1,1,7-tris(3-methylbut-2-en-1-yl)xanthene-2,9-dione
(2s,3r,4s,5s,6r)-2-{[(3r)-3,7-dimethylocta-1,6-dien-3-yl]oxy}-6-({[(2s,3r,4s,5s)-3,4,5-trihydroxyoxan-2-yl]oxy}methyl)oxane-3,4,5-triol
7-ethyl-8,16-dihydroxy-3-methyl-19-(4-methyl-5-oxooxolan-2-yl)-5,17-dioxa-13,15-diazapentacyclo[11.4.2.0¹,¹⁴.0²,⁶.0⁸,¹⁴]nonadec-15-en-4-one
2-{[(3,4,5-trihydroxyoxan-2-yl)oxy]methyl}-6-({1,7,7-trimethylbicyclo[2.2.1]heptan-2-yl}oxy)oxane-3,4,5-triol
(2r,3r,4s,5r,6r)-2-{[(2e)-3,7-dimethylocta-2,6-dien-1-yl]oxy}-6-({[(2r,3r,4r,5r)-3,4,5-trihydroxyoxan-2-yl]oxy}methyl)oxane-3,4,5-triol
2-({[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-6-[(3,7-dimethylocta-1,6-dien-3-yl)oxy]oxane-3,4,5-triol
10-epiatractyloside a
{"Ingredient_id": "HBIN000111","Ingredient_name": "10-epiatractyloside a","Alias": "NA","Ingredient_formula": "C21H36O10","Ingredient_Smile": "CC1(C2CC(CCC(C2CC1=O)(CO)O)C(C)(C)OC3C(C(C(C(O3)CO)O)O)O)O","Ingredient_weight": "448.5 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "SMIT15248","TCMID_id": "6832","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "11015789","DrugBank_id": "NA"}
2-(8-methyl-2,8-dihydroxy-9-oxo-2-hydroxymethylbicyclo[5.3.0]decan-7-yl)isopropanol glucoside
{"Ingredient_id": "HBIN005066","Ingredient_name": "2-(8-methyl-2,8-dihydroxy-9-oxo-2-hydroxymethylbicyclo[5.3.0]decan-7-yl)isopropanol glucoside","Alias": "10-epi-Atractyloside A","Ingredient_formula": "C21H36O10","Ingredient_Smile": "CC1(C2CC(CCC(C2CC1=O)(CO)O)C(C)(C)OC3C(C(C(C(O3)CO)O)O)O)O","Ingredient_weight": "448.5 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "SMIT16591","TCMID_id": "14309","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "11015789","DrugBank_id": "NA"}
(4s)-α-terpineol o-β-d-apiofuranosyl-(1→6)-β-d-glucopyranoside
{"Ingredient_id": "HBIN010909","Ingredient_name": "(4s)-\u03b1-terpineol o-\u03b2-d-apiofuranosyl-(1\u21926)-\u03b2-d-glucopyranoside","Alias": "NA","Ingredient_formula": "C21H36O10","Ingredient_Smile": "CC1=CCC(CC1)C(C)(C)OC2C(C(C(C(O2)COC3C(C(CO3)(CO)O)O)O)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "20980","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}