Exact Mass: 452.1484
Exact Mass Matches: 452.1484
Found 212 metabolites which its exact mass value is equals to given mass value 452.1484
,
within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error
0.001 dalton.
5alpha-Androstan-3alpha,17beta-diol disulfate
5alpha-Androstan-3alpha,17beta-diol disulfate, also known as 5α-androstan-3α,17β-diol disulfuric acid, is classified as a member of the sulfated steroids. Sulfated steroids are sterol lipids containing a sulfate group attached to the steroid skeleton. 5alpha-Androstan-3alpha,17beta-diol disulfate is considered to be a practically insoluble (in water) and an extremely strong acidic compound. 5alpha-Androstan-3alpha,17beta-diol disulfate can be found in feces.
5alpha-Androstan-3beta,17alpha-diol disulfate
5alpha-Androstan-3beta,17alpha-diol disulfate belongs to the class of organic compounds known as sulfated steroids. These are sterol lipids containing a sulfate group attached to the steroid skeleton. 5alpha-Androstan-3beta,17alpha-diol disulfate was identified as one of forty plasma metabolites that could be used to predict gut microbiome Shannon diversity (PMID: 31477923). Shannon diversity is a metric that summarizes both species abundance and evenness, and it has been suggested as a marker for microbiome health.
Epimedokoreanin A
(9R,10S)-rel-(-)-9,10-bis(Acetyloxy)-9,10-dihydro-5-methoxy-8,8-dimethyl-2-phenyl-4H,8H-benzo[1,2-b:3,4-b]dipyran-4-one
5-hydroxymorusin|5-hydroxy-8,8-dimethyl-3-(3-methyl-2-butenyl)-2-(2,4,5-trihydroxyphenyl)-4H,8H-benzo(1,2-b:3,4-b)-pyran-4-one|5-hydroxymorusin|artonin E|hydroxyartoflavone A
(2E)-3-[3-(3,4-dihydroxybenzyl)-6-hydroxy-2,4-dimethoxyphenyl]-1-(3-hydroxy-4-methoxyphenyl)prop-2-en-1-one|3,6-dihydroxy-2,4,4-trimethoxy-3-(3,4-dihydroxybenzyl)chalcone
9-(1-Hydroperoxy-isopropyl)-6,12-dihydroxy-3,3-dimethyl-8H,9H-benzo[f]pyrano[6,5-8,7]chromeno[3,2-d]oxepin-7-one
5-Methoxy-(3,4-dihydro-3,4-diacetoxy)-2,2-dimethylpyrano-(7,8:5,6)-flavone
(E)-1-(glutathion-S-yl)-N-hydroxy-omega-(methylsulfanyl)pentan-1-imine
methyl 3-(3,4-dihydroxyphenyl)-2-[(2,2-dimethylchromen-6-yl)methyl]-4-methoxy-5-oxofuran-2-carboxylate
methyl 3-(3,4-dihydroxyphenyl)-2-[(2,2-dimethylchromen-6-yl)methyl]-4-methoxy-5-oxofuran-2-carboxylate [IIN-based on: CCMSLIB00000846691]
methyl 3-(3,4-dihydroxyphenyl)-2-[(2,2-dimethylchromen-6-yl)methyl]-4-methoxy-5-oxofuran-2-carboxylate [IIN-based: Match]
Ala Cys Glu Met
Ala Cys Met Glu
Ala Glu Cys Met
Ala Glu Met Cys
Ala Met Cys Glu
Ala Met Glu Cys
Cys Ala Glu Met
Cys Ala Met Glu
Cys Cys Asp Ile
Cys Cys Asp Leu
Cys Cys Glu Val
Cys Cys Ile Asp
Cys Cys Leu Asp
Cys Cys Val Glu
Cys Asp Cys Ile
Cys Asp Cys Leu
Cys Asp Ile Cys
Cys Asp Leu Cys
Cys Glu Ala Met
Cys Glu Cys Val
Cys Glu Met Ala
Cys Glu Thr Thr
Cys Glu Val Cys
Cys Ile Cys Asp
Cys Ile Asp Cys
Cys Leu Cys Asp
Cys Leu Asp Cys
Cys Met Ala Glu
Cys Met Glu Ala
Cys Thr Glu Thr
Cys Thr Thr Glu
Cys Val Cys Glu
Cys Val Glu Cys
Asp Cys Cys Ile
Asp Cys Cys Leu
Asp Cys Ile Cys
Asp Cys Leu Cys
Asp Asp Phe Gly
Asp Asp Gly Phe
Asp Phe Asp Gly
Asp Phe Gly Asp
Asp Gly Asp Phe
Asp Gly Phe Asp
Asp Gly Met Met
Asp Ile Cys Cys
Asp Leu Cys Cys
Asp Met Gly Met
Asp Met Met Gly
Asp Met Ser Thr
Asp Met Thr Ser
Asp Ser Met Thr
Asp Ser Thr Met
Asp Thr Met Ser
Asp Thr Ser Met
Glu Ala Cys Met
Glu Ala Met Cys
Glu Cys Ala Met
Glu Cys Cys Val
Glu Cys Met Ala
Glu Cys Thr Thr
Glu Cys Val Cys
Glu Met Ala Cys
Glu Met Cys Ala
Glu Met Ser Ser
Glu Ser Met Ser
Glu Ser Ser Met
Glu Thr Cys Thr
Glu Thr Thr Cys
Glu Val Cys Cys
Phe Asp Asp Gly
Phe Asp Gly Asp
Phe Gly Asp Asp
Gly Asp Asp Phe
Gly Asp Phe Asp
Gly Asp Met Met
Gly Phe Asp Asp
Gly Met Asp Met
Gly Met Met Asp
Ile Cys Cys Asp
Ile Cys Asp Cys
Ile Asp Cys Cys
Leu Cys Cys Asp
Leu Cys Asp Cys
Leu Asp Cys Cys
Met Ala Cys Glu
Met Ala Glu Cys
Met Cys Ala Glu
Met Cys Glu Ala
Met Asp Gly Met
Met Asp Met Gly
Met Asp Ser Thr
Met Asp Thr Ser
Met Glu Ala Cys
Met Glu Cys Ala
Met Glu Ser Ser
Met Gly Asp Met
Met Gly Met Asp
Met Met Asp Gly
Met Met Gly Asp
Met Ser Asp Thr
Met Ser Glu Ser
Met Ser Ser Glu
Met Ser Thr Asp
Met Thr Asp Ser
Met Thr Ser Asp
Ser Asp Met Thr
Ser Asp Thr Met
Ser Glu Met Ser
Ser Glu Ser Met
Ser Met Asp Thr
Ser Met Glu Ser
Ser Met Ser Glu
Ser Met Thr Asp
Ser Ser Glu Met
Ser Ser Met Glu
Ser Thr Asp Met
Ser Thr Met Asp
Thr Cys Glu Thr
Thr Cys Thr Glu
Thr Asp Met Ser
Thr Asp Ser Met
Thr Glu Cys Thr
Thr Glu Thr Cys
Thr Met Asp Ser
Thr Met Ser Asp
Thr Ser Asp Met
Thr Ser Met Asp
Thr Thr Cys Glu
Thr Thr Glu Cys
Val Cys Cys Glu
Val Cys Glu Cys
Val Glu Cys Cys
17-Acetyloxy-6-chloro-1α-chloromethylpregna-4,6-diene-3,20-dione
4-[6-(1-benzylpyrrol-2-yl)-4-(2-hydroxy-4-oxocyclohexa-2,5-dien-1-ylidene)-1H-1,3,5-triazin-2-ylidene]-3-hydroxycyclohexa-2,5-dien-1-one
CARBONYLHYDRIDO[6-(DI-T-BUTYLPHOSPHINOMETHYLENE)-2-(N,N-DIETHYLAMINOMETHYL)-1,6-DIHYDROPYRIDINE]RUTHENIUM(II)
Aiphanol
A lignan that is (2R)-2,3-dihydro-1,4-benzodioxin-2-ylmethanol which is substituted by a 2-(3,5-dihydroxyphenyl)ethenyl group at position 6 and a 4-hydroxy-3,5-dimethoxyphenyl group at position 3. It is a stilbenolignan isolated from the seeds of Aiphanes aculeata and exhibits potent inhibitory efficacy against cyclooxygenase-1 and -2 (COX-1 and COX-2).
6-[3-(cyclopropylmethoxy)-4-methoxyphenyl]-3-(2,5-dimethoxyphenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
Ethyl 2-[2-[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxoethyl]-1-oxoisoquinolin-5-yl]oxypropanoate
N-[[1-(beta-D-Glucopyranosyl)-1H-indole-3-yl]acetyl]-L-aspartic acid
(2S)-2-amino-5-[[(2R)-1-(carboxymethylamino)-3-[(E)-N-hydroxy-C-(4-methylsulfanylbutyl)carbonimidoyl]sulfanyl-1-oxopropan-2-yl]amino]-5-oxopentanoic acid
5-Hydroxy-3-(4-hydroxy-3-methyl-but-2-enyl)-8,8-dimethyl-2-(2,4,5-trihydroxy-phenyl)-8H-pyrano[2,3-f]chromen-4-one
An extended flavonoid that is flavone substituted by hydroxy groups at positions 5, 2, 4 and 5, a 3-(hydroxymethyl)but-2-en-1-yl group at position 3 and a 6,6-dimethyl-3,6-dihydro-2H-pyran group across positions 7 and 8. It has been isolated from Artocarpus odoratissimus.
3,4-dimethoxy-N-[(E)-(2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)methylideneamino]benzamide
Methyl 3-(3,4-dihydroxyphenyl)-2-[(2,2-dimethylchromen-6-yl)methyl]-4-methoxy-5-oxofuran-2-carboxylate
(2S)-2-amino-6-[[4-amino-1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(phosphonooxymethyl)oxolan-2-yl]pyrimidin-1-ium-2-yl]amino]hexanoic acid
9-[(2R,4R,5S,6R)-4,5-dihydroxy-6-methyloxan-2-yl]-3,8-dihydroxy-3-methyl-2,4-dihydrobenzo[a]anthracene-1,7,12-trione
IEM-1460
IEM-1460 blocks both AMPA and NMDA glutamate receptor with anticonvulsant effect in vivo[1].
(16s)-16-(2-hydroperoxypropan-2-yl)-11,20-dihydroxy-7,7-dimethyl-2,8,17-trioxapentacyclo[12.9.0.0³,¹².0⁴,⁹.0¹⁸,²³]tricosa-1(14),3,5,9,11,18,20,22-octaen-13-one
3-{3-[(3,4-dihydroxyphenyl)methyl]-6-hydroxy-2,4-dimethoxyphenyl}-1-(3-hydroxy-4-methoxyphenyl)prop-2-en-1-one
(8r)-5-hydroxy-8-(prop-1-en-2-yl)-2-[(3s,4s)-3,4,8-trihydroxy-2,2-dimethyl-3,4-dihydro-1-benzopyran-6-yl]-8h,9h-furo[2,3-h]chromen-4-one
5-methoxy-(3'',4''-dihydro-3'',4''-diacetoxy)-2'',2''-dimethylpyrano-(7,8:5'',6'')-flavone
{"Ingredient_id": "HBIN011733","Ingredient_name": "5-methoxy-(3'',4''-dihydro-3'',4''-diacetoxy)-2'',2''-dimethylpyrano-(7,8:5'',6'')-flavone","Alias": "NA","Ingredient_formula": "C25H24O8","Ingredient_Smile": "CC(=O)OC1C(C(OC2=CC(=C3C(=O)C=C(OC3=C12)C4=CC=CC=C4)OC)(C)C)OC(=O)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "13901","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
anticancerstilbenolignan pmv70p691-042
{"Ingredient_id": "HBIN016364","Ingredient_name": "anticancerstilbenolignan pmv70p691-042","Alias": "NA","Ingredient_formula": "C25H24O8","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "1448","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}