Exact Mass: 680.1741
Exact Mass Matches: 680.1741
Found 220 metabolites which its exact mass value is equals to given mass value 680.1741,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Canaliculatol
cis-Miyabenol C
Constituent of the fruit of Foeniculum vulgare (fennel). cis-Miyabenol C is found in fennel and herbs and spices. cis-Miyabenol C is found in fennel. cis-Miyabenol C is a constituent of the fruit of Foeniculum vulgare (fennel).
7-Hydroxy-2',5,6-trimethoxy-4',5'-methylenedioxyisoflavone 7-(2-p-coumaroylglucoside)
7-Hydroxy-2,5,6-trimethoxy-4,5-methylenedioxyisoflavone 7-(2-p-coumaroylglucoside) is found in fruits. 7-Hydroxy-2,5,6-trimethoxy-4,5-methylenedioxyisoflavone 7-(2-p-coumaroylglucoside) is a constituent of the seeds of Trichosanthes anguina (snake gourd). Constituent of the seeds of Trichosanthes anguina (snake gourd). 7-Hydroxy-2,5,6-trimethoxy-4,5-methylenedioxyisoflavone 7-(2-p-coumaroylglucoside) is found in fruits.
Viniferol D
Chrysoeriol 7-O-(6'-malonyl-apiosyl-glucoside)
Chrysoeriol 7-o-(6-malonyl-apiosyl-glucoside) is a member of the class of compounds known as flavonoid-7-o-glycosides. Flavonoid-7-o-glycosides are phenolic compounds containing a flavonoid moiety which is O-glycosidically linked to carbohydrate moiety at the C7-position. Chrysoeriol 7-o-(6-malonyl-apiosyl-glucoside) is practically insoluble (in water) and a weakly acidic compound (based on its pKa). Chrysoeriol 7-o-(6-malonyl-apiosyl-glucoside) can be found in celery leaves and wild celery, which makes chrysoeriol 7-o-(6-malonyl-apiosyl-glucoside) a potential biomarker for the consumption of these food products.
Kaempferol 3-(6G-malonylneohesperidoside)
trans-Diptoindonesin B
A benzofuran-derived stilbenoid that is a homotrimer obtained by cyclotrimerisation of resveratrol. It is isolated from Dryobalanops oblongifolia.
Okanin 4-(2,4-diacetyl-6-p-coumarylglucoside)
(rel)-2-(6-benzoyl-beta-glucopyranosyloxy)-7-(6alpha-benzoyloxy-1alpha,2alpha-dihydroxy-5-oxo-cyclohex-3-enoyl)-5-hydroxybenzyl alcohol
7-O-(6-O-Malonylneohesperidoside)-3,4,5,7-Tetrahydroxyflavone
(2S)-5,7,5-trihydroxyflavanone 2-O-beta-D-6-O-acetylglucopyranosyl-(1->3)-alpha-L-2-O-acetylrhamnopyranoside
arillatose E|O-beta-D-glucopyranosyl(1->3)-alpha-D-glucopyranosyl 3-O-feruloyl-beta-D-fructofuranoside
arillatose C|O-beta-D-fructofuranosyl(1->3)-6-O-feruloyl-alpha-D-glucopyranosyl beta-D-glucopyranoside
1-(3,5-dihydroxyphenyl)-1,2,6,6a,11,11a-hexahydro-2,6,11-tri(4-hydroxyphenyl)indeno[1,2:2,3]indeno[S,A-b]furan-5,8,10-triol|carasiphenol C
2-O-(4, 6-Di-O-benzoyl-beta-D-glucopyranoside)-2, 5-Dihydroxybenzyl 1, 2, 6-trihydroxy-5-oxo-3-cyclohexene-1-carboxylate
quercetin 3-O-beta-D-glucopyranosyl-7-O-alpha-L-(3-O-isobutyryl)rhamnopyranoside|Sinocrassoside B7
miyabenol C
Cis-miyabenol c is a member of the class of compounds known as 2-arylbenzofuran flavonoids. 2-arylbenzofuran flavonoids are phenylpropanoids containing the 2-phenylbenzofuran moiety. Cis-miyabenol c is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Cis-miyabenol c can be found in fennel and herbs and spices, which makes cis-miyabenol c a potential biomarker for the consumption of these food products.
(2S)-pinocembrin 7-O-[cinnamoyl(1->5)-beta-D-apiosyl(1->2)]-beta-D-glucoside|pinocembrin 7-O-[5-O-cinnamoyl-beta-D-apiofuranosyl(1-2)-beta-D-glucopyranoside]
alpha-GlcA-(1<*>3)-alpha-Man-(1<*>2)-alpha-Man-(1<*>3)-Gal|alpha-GlcA-(1[*]3)-alpha-Man-(1[*]2)-alpha-Man-(1[*]3)-Gal
Carasiphenol C
Kaempferol 3-O-(2-O-α-rhamnosyl-6-O-malonyl-β-glucoside)
Kaempferol 3-O-(2-O-alpha-rhamnosyl-6-O-malonyl-beta-glucoside) is a natural product found in Clitoria ternatea with data available.
7-Hydroxy-2',5,6-trimethoxy-4',5'-methylenedioxyisoflavone 7-(2-p-coumaroylglucoside)
sodium,2-[(Z)-[3-[[bis(carboxymethyl)amino]methyl]-4-hydroxy-5-methylphenyl]-[3-[[bis(carboxymethyl)amino]methyl]-5-methyl-4-oxocyclohexa-2,5-dien-1-ylidene]methyl]benzoate
1,3-bis[2,6-di(propan-2-yl)phenyl]imidazolidin-2-ide,3-chloropyridine,dichloropalladium
1-N,4-N-bis(4-bromophenyl)-1-N,4-N-bis(4-butylphenyl)benzene-1,4-diamine
OXO[5,10,15,20-TETRA(4-PYRIDYL)PORPHINATO]TITANIUM(IV) [DETERMINATION OF GLUCOSE IN SERAM AND URINE]
cis-Miyabenol C
Cis-miyabenol c is a member of the class of compounds known as 2-arylbenzofuran flavonoids. 2-arylbenzofuran flavonoids are phenylpropanoids containing the 2-phenylbenzofuran moiety. Cis-miyabenol c is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Cis-miyabenol c can be found in fennel and herbs and spices, which makes cis-miyabenol c a potential biomarker for the consumption of these food products.
6-[(6-{[3-(3,4-dimethoxyphenyl)-7-methoxy-8-methyl-4-oxo-4H-chromen-5-yl]oxy}-3,4,5-trihydroxyoxan-2-yl)methoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
(E)-trans-miyabenol C
A benzofuran-derived stilbenoid that is a homotrimer obtained by cyclotrimerisation of resveratrol.
(1r,2r,3r,9s,10s,17s)-2-(3,5-dihydroxyphenyl)-3,9,17-tris(4-hydroxyphenyl)-8-oxapentacyclo[8.7.2.0⁴,¹⁸.0⁷,¹⁹.0¹¹,¹⁶]nonadeca-4,6,11,13,15,18-hexaene-5,13,15-triol
5-{4-hydroxy-6-[(2s,3s)-6-hydroxy-2-(4-hydroxyphenyl)-4-[(1z)-2-(4-hydroxyphenyl)ethenyl]-2,3-dihydro-1-benzofuran-3-yl]-2-(4-hydroxyphenyl)-2,3-dihydro-1-benzofuran-3-yl}benzene-1,3-diol
(1e,2s,3s)-2-(3,5-dihydroxyphenyl)-1-{[(2s,3s)-3-(3,5-dihydroxyphenyl)-2-(4-hydroxyphenyl)-2,3-dihydro-1-benzofuran-5-yl]methylidene}-3-(4-hydroxyphenyl)-2,3-dihydroindene-4,6-diol
[(3s,4r,5s)-5-{[(2s,3r,4s,5s,6r)-4,5-dihydroxy-2-{[(2s)-5-hydroxy-4-oxo-2-phenyl-2,3-dihydro-1-benzopyran-7-yl]oxy}-6-(hydroxymethyl)oxan-3-yl]oxy}-3,4-dihydroxyoxolan-3-yl]methyl (2e)-3-phenylprop-2-enoate
(2s,3s,10r,11r,18r,19r)-3,11,19-tris(4-hydroxyphenyl)-20-oxahexacyclo[16.6.1.0²,¹⁰.0⁴,⁹.0¹²,¹⁷.0²¹,²⁵]pentacosa-1(24),4,6,8,12,14,16,21(25),22-nonaene-5,7,13,15,23-pentol
(1s,14r,15s,22z,23s)-23-(3,5-dihydroxyphenyl)-15-(4-hydroxyphenyl)-22-[(4-hydroxyphenyl)methylidene]pentacyclo[12.9.0.0²,⁷.0⁸,¹³.0¹⁶,²¹]tricosa-2,4,6,8,10,12,16,18,20-nonaene-5,9,11,17,19-pentol
2-(acetyloxy)-5,6-bis(benzoyloxy)-4'-hydroxy-4-(4-hydroxyphenyl)-[1,1'-biphenyl]-3-yl benzoate
5-[(2r,3r)-6-hydroxy-4-[(2r,3r)-6-hydroxy-2-(4-hydroxyphenyl)-4-[(1e)-2-(4-hydroxyphenyl)ethenyl]-2,3-dihydro-1-benzofuran-3-yl]-2-(4-hydroxyphenyl)-2,3-dihydro-1-benzofuran-3-yl]benzene-1,3-diol
(1r,2s,3s,9s,10s,17s)-2-(3,5-dihydroxyphenyl)-3,9,17-tris(4-hydroxyphenyl)-8-oxapentacyclo[8.7.2.0⁴,¹⁸.0⁷,¹⁹.0¹¹,¹⁶]nonadeca-4,6,11,13,15,18-hexaene-5,13,15-triol
5-{4-hydroxy-6-[4-hydroxy-2-(4-hydroxyphenyl)-6-[2-(4-hydroxyphenyl)ethenyl]-2,3-dihydro-1-benzofuran-3-yl]-2-(4-hydroxyphenyl)-2,3-dihydro-1-benzofuran-3-yl}benzene-1,3-diol
(1r,2s,9r,10s,17r,18r)-9,17-bis(4-hydroxyphenyl)heptacyclo[16.12.0.0²,¹⁰.0³,⁸.0¹¹,¹⁶.0¹⁹,²⁴.0²⁵,³⁰]triaconta-3,5,7,11,13,15,19,21,23,25,27,29-dodecaene-5,7,13,15,21,23,27-heptol
(1s,2r,3r,10r,11r,15s,16r,17s)-16-(3,5-dihydroxyphenyl)-6,8-dihydroxy-2,10,17-tris(4-hydroxyphenyl)pentacyclo[13.2.1.0¹,¹².0³,¹¹.0⁴,⁹]octadeca-4,6,8,12-tetraene-14,18-dione
(1r,6s,7s,11r,12r,19r)-7-(3,5-dihydroxyphenyl)-6,11,19-tris(4-hydroxyphenyl)-5-oxapentacyclo[10.7.0.0²,¹⁰.0⁴,⁸.0¹³,¹⁸]nonadeca-2(10),3,8,13,15,17-hexaene-9,15,17-triol
(2s,3s,4r,5r)-2-{[(2r,3r,4r,5s,6r)-3,4-dihydroxy-6-(hydroxymethyl)-5-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-4-hydroxy-2,5-bis(hydroxymethyl)oxolan-3-yl (2e)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate
(1r,2s,3r,4r,10s,11s)-4-(3,5-dihydroxyphenyl)-3,11-bis(4-hydroxyphenyl)hexacyclo[8.7.6.1²,⁵.0¹²,¹⁷.0¹⁸,²³.0⁹,²⁴]tetracosa-5(24),6,8,12,14,16,18,20,22-nonaene-6,8,14,19,21-pentol
(2s,3s,10r,11r,18s,19r,21s,25s)-3,11,19-tris(4-hydroxyphenyl)-4,12,20-trioxaheptacyclo[16.6.1.1²,⁵.1¹⁰,¹³.0²¹,²⁵.0⁹,²⁷.0¹⁷,²⁶]heptacosa-1(24),5(27),6,8,13(26),14,16,22-octaene-7,15,23-triol
(1z,2s,3s)-2-(3,5-dihydroxyphenyl)-1-{[(2r,3r)-3-(3,5-dihydroxyphenyl)-2-(4-hydroxyphenyl)-2,3-dihydro-1-benzofuran-5-yl]methylidene}-3-(4-hydroxyphenyl)-2,3-dihydroindene-4,6-diol
(2s)-pinocembrin 7-o-[cinnamoyl(1→5)-β-d-234apiosyl(1→2)]-β-d-glucoside
{"Ingredient_id": "HBIN006822","Ingredient_name": "(2s)-pinocembrin 7-o-[cinnamoyl(1\u21925)-\u03b2-d-234apiosyl(1\u21922)]-\u03b2-d-glucoside","Alias": "NA","Ingredient_formula": "C35H36O14","Ingredient_Smile": "C1C(OC2=CC(=CC(=C2C1=O)O)OC3C(C(C(C(O3)CO)O)O)OC4C(C(CO4)(COC(=O)C=CC5=CC=CC=C5)O)O)C6=CC=CC=C6","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "17393","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
ampelopsin g
{"Ingredient_id": "HBIN015898","Ingredient_name": "ampelopsin g","Alias": "NA","Ingredient_formula": "C42H32O9","Ingredient_Smile": "C1=CC(=CC=C1C2C3C(C4=C(C2C5=C3C6=C(C=C5O)OC(C6C7=CC(=CC(=C7)O)O)C8=CC=C(C=C8)O)C=C(C=C4O)O)C9=CC=C(C=C9)O)O","Ingredient_weight": "680.7","OB_score": "NA","CAS_id": "151487-09-1","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "6826","PubChem_id": "102277095","DrugBank_id": "NA"}
amurensin b
{"Ingredient_id": "HBIN015917","Ingredient_name": "amurensin b","Alias": "NA","Ingredient_formula": "C42H32O9","Ingredient_Smile": "C1=CC(=CC=C1C=CC2=C3C(C(OC3=CC4=C2C(C(O4)C5=CC=C(C=C5)O)C6=CC(=CC(=C6)O)O)C7=CC=C(C=C7)O)C8=CC(=CC(=C8)O)O)O","Ingredient_weight": "680.7 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "1092","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "101017690","DrugBank_id": "NA"}
amurensin g
{"Ingredient_id": "HBIN015920","Ingredient_name": "amurensin g","Alias": "NA","Ingredient_formula": "C42H32O9","Ingredient_Smile": "C1=CC(=CC=C1C2C3C(C4=C(C=C(C=C4C5C(OC6=CC(=C(C2C7=CC(=CC(=C7)O)O)C3=C56)O)C8=CC=C(C=C8)O)O)O)C9=CC=C(C=C9)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "1095","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
arillatose c
{"Ingredient_id": "HBIN016746","Ingredient_name": "arillatose c","Alias": "NA","Ingredient_formula": "C28H40O19","Ingredient_Smile": "COC1=C(C=CC(=C1)C=CC(=O)OCC2C(C(C(C(O2)OC3(C(C(C(O3)CO)O)O)CO)O)OC4C(C(C(C(O4)CO)O)O)O)O)O","Ingredient_weight": "680.6 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "1686","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "21606607","DrugBank_id": "NA"}
arillatose e
{"Ingredient_id": "HBIN016748","Ingredient_name": "arillatose e","Alias": "NA","Ingredient_formula": "C28H40O19","Ingredient_Smile": "COC1=C(C=CC(=C1)C=CC(=O)OC2C(C(OC2(CO)OC3C(C(C(C(O3)CO)O)OC4C(C(C(C(O4)CO)O)O)O)O)CO)O)O","Ingredient_weight": "680.6 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "1688","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "21606609","DrugBank_id": "NA"}
