Exact Mass: 254.13381420000002

Exact Mass Matches: 254.13381420000002

Found 199 metabolites which its exact mass value is equals to given mass value 254.13381420000002, within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error 0.001 dalton.

Elymoclavin

Ergoline-8-methanol,8,9-didehydro-6-methyl-

C16H18N2O (254.1419058)


   
   

Midodrine

(+-)-2-Amino-N-(beta-hydroxy-2,5-dimethoxyphenethyl)acetamide

C12H18N2O4 (254.1266508)


Midodrine is only found in individuals that have used or taken this drug. It is an ethanolamine derivative that is an adrenergic alpha agonist. It is used as a vasoconstrictor agent in the treatment of hypotension. [PubChem]Midodrine forms an active metabolite, desglymidodrine, that is an alpha1-agonist, and exerts its actions via activation of the alpha-adrenergic receptors of the arteriolar and venous vasculature, producing an increase in vascular tone and elevation of blood pressure. Desglymidodrine does not stimulate cardiac beta-adrenergic receptors. C - Cardiovascular system > C01 - Cardiac therapy > C01C - Cardiac stimulants excl. cardiac glycosides > C01CA - Adrenergic and dopaminergic agents D018373 - Peripheral Nervous System Agents > D001337 - Autonomic Agents > D013566 - Sympathomimetics C78272 - Agent Affecting Nervous System > C29747 - Adrenergic Agent > C87053 - Adrenergic Agonist D018377 - Neurotransmitter Agents > D018663 - Adrenergic Agents > D000322 - Adrenergic Agonists D002317 - Cardiovascular Agents > D014662 - Vasoconstrictor Agents Midodrine is an α1-receptor agonist, for the treatment of dysautonomia and orthostatic hypotension.

   

Chanoclavine-I aldehyde

Chanoclavine-I aldehyde

C16H18N2O (254.1419058)


An enal resulting from the oxidation of the primary alcohol group of chanoclavine-I to the corresponding aldehyde.

   

(+)-Setoclavine

4,6-dimethyl-6,11-diazatetracyclo[7.6.1.0²,⁷.0¹²,¹⁶]hexadeca-1(16),2,9,12,14-pentaen-4-ol

C16H18N2O (254.1419058)


(+)-Setoclavine is found in cereals and cereal products. (+)-Setoclavine is an alkaloid from ergot found on Pennisetum typhoideum (pearl millet). Alkaloid from ergot found on Pennisetum typhoideum (pearl millet). (+)-Setoclavine is found in cereals and cereal products.

   

Homoanserine

(2S)-2-[(4-Amino-1-hydroxybutylidene)amino]-3-(1-methyl-1H-imidazol-5-yl)propanoate

C11H18N4O3 (254.1378838)


Homoanserine (N-(4-Aminobutyryl)-L-histidine) is a dipeptide identified in the brain and muscles of mammals. (PMID 3780724, 6078589) It has been found that homoanserine is not merely deposited in skeletal muscles but that is actively synthesized by muscle cells in culture. (PMID 8307008) [HMDB] Homoanserine (N-(4-Aminobutyryl)-L-histidine) is a dipeptide identified in the brain and muscles of mammals. (PMID 3780724, 6078589) It has been found that homoanserine is not merely deposited in skeletal muscles but that is actively synthesized by muscle cells in culture. (PMID 8307008).

   

L-Furosine

N-[[3-oxo-2-(2-Pentenyl)cyclopentyl]acetyl]isoleucine, 9ci

C12H18N2O4 (254.1266508)


L-Furosine is an analytical indicator of heat treatment damage or storage deterioriation in milk, dried foods, pasta, tomato paste and eggs. Acid hydrolysis product of the Amadori compoun

   

L-Pyridosine

2-amino-6-(5-hydroxy-2-methyl-4-oxo-1,4-dihydropyridin-1-yl)hexanoic acid

C12H18N2O4 (254.1266508)


L-Pyridosine is found in milk and milk products. Acid hydrolysis product of heated milk. Marker for heat treatment of milk and other foodstuff

   

Valylhistidine

(2S)-2-[[(2S)-2-amino-3-methylbutanoyl]amino]-3-(1H-imidazol-5-yl)propanoic acid

C11H18N4O3 (254.1378838)


Valylhistidine is a dipeptide composed of valine and histidine. It is an incomplete breakdown product of protein digestion or protein catabolism. Dipeptides are organic compounds containing a sequence of exactly two alpha-amino acids joined by a peptide bond. Some dipeptides are known to have physiological or cell-signalling effects although most are simply short-lived intermediates on their way to specific amino acid degradation pathways following further proteolysis.

   

Histidylvaline

(2S)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-3-methylbutanoic acid

C11H18N4O3 (254.1378838)


Histidylvaline is a dipeptide composed of histidine and valine. It is an incomplete breakdown product of protein digestion or protein catabolism. Dipeptides are organic compounds containing a sequence of exactly two alpha-amino acids joined by a peptide bond. Some dipeptides are known to have physiological or cell-signalling effects although most are simply short-lived intermediates on their way to specific amino acid degradation pathways following further proteolysis.

   

Isoeugenol benzyl ether

1-(benzyloxy)-2-methoxy-4-[(1Z)-prop-1-en-1-yl]benzene

C17H18O2 (254.1306728)


Isoeugenol benzyl ether is a flavouring ingredien Flavouring ingredient

   

Isoeugenyl benzyl ether

1-(benzyloxy)-2-methoxy-4-[(1E)-prop-1-en-1-yl]benzene

C17H18O2 (254.1306728)


Isoeugenyl benzyl ether is used as a food additive [EAFUS] ("EAFUS: Everything Added to Food in the United States. [http://www.eafus.com/]")

   

Pyrraline

2-amino-6-[2-formyl-5-(hydroxymethyl)-1H-pyrrol-1-yl]hexanoic acid

C12H18N2O4 (254.1266508)


Pyrraline is Maillard produced, obtained by reaction between BCS47-B and HHS42-T. Maillard production obtained by reacn. between BCS47-B and HHS42-T.

   

4-[(2-Methyl-3-furanyl)thio]-5-nonanone

1,3-Dipropylacetonyl 2-methyl-3-furyl sulfide

C14H22O2S (254.1340432)


4-[(2-Methyl-3-furanyl)thio]-5-nonanone is a flavouring ingredient. Flavouring ingredient

   

2,6-Dimethyl-3-[(2-methyl-3-furanyl)thio]-4-heptanone

2,6-Dimethyl-3-[(2-methylfuran-3-yl)sulphanyl]heptan-4-one

C14H22O2S (254.1340432)


2,6-Dimethyl-3-[(2-methyl-3-furanyl)thio]-4-heptanone is a flavouring ingredient. Flavouring ingredient

   

(S)-Argpyrimidine

2-Amino-5-[(5-hydroxy-4,6-dimethyl-1,2-dihydropyrimidin-2-ylidene)amino]pentanoate

C11H18N4O3 (254.1378838)


(S)-Argpyrimidine is found in alcoholic beverages. (S)-Argpyrimidine is found in beer.

   

Aldosine

5-(6-Carboxy-2-piperidinyl)-1,2,3,4-tetrahydro-2-pyridinecarboxylic acid, 9ci

C12H18N2O4 (254.1266508)


Aldosine is found in animal foods. Aldosine is a hydrolysis product from the aldol crosslinks of bovine elastin and collagen. Hydrolysis product from the aldol crosslinks of bovine elastin and collagen. Aldosine is found in animal foods.

   

4-(8-Amino-1,2,3,4-tetrahydro-2-methyl-4-isoquinolinyl)phenol

4-(8-amino-2-methyl-1,2,3,4-tetrahydroisoquinolin-4-yl)phenol

C16H18N2O (254.1419058)


   

Elymoclavine

{6-methyl-6,11-diazatetracyclo[7.6.1.0²,⁷.0¹²,¹⁶]hexadeca-1(16),3,9,12,14-pentaen-4-yl}methanol

C16H18N2O (254.1419058)


   

Isolysergol

{6-methyl-6,11-diazatetracyclo[7.6.1.0²,⁷.0¹²,¹⁶]hexadeca-1(16),2,9,12,14-pentaen-4-yl}methanol

C16H18N2O (254.1419058)


   

Pimonidazole

1-(2-nitro-1H-imidazol-1-yl)-3-(piperidin-1-yl)propan-2-ol

C11H18N4O3 (254.1378838)


C274 - Antineoplastic Agent > C798 - Radiosensitizing Agent D011838 - Radiation-Sensitizing Agents

   

3,5-Dihydroxy-4-isopropylstilbene

5-(2-phenylethenyl)-2-(propan-2-yl)benzene-1,3-diol

C17H18O2 (254.1306728)


   

Micrandrol F

1,2-Dimethyl-6-hydroxy-7-methoxy-9,10-dihydrophenanthrene

C17H18O2 (254.1306728)


   

4-Chloro-3,7(14)-chamigradien-9-ol

4-Chloro-3,7(14)-chamigradien-9-ol

C15H23ClO (254.14373379999998)


   
   
   

N-methyl-N-[3-phenyl-3-(pyridin-2-yl)propyl]formamide

N-methyl-N-[3-phenyl-3-(pyridin-2-yl)propyl]formamide

C16H18N2O (254.1419058)


   

Pheniramine M (bis-nor), acetylated

Pheniramine M (bis-nor), acetylated

C16H18N2O (254.1419058)


   

3-Hydroxy-1,5-diphenyl-1-pentanone

3-Hydroxy-1,5-diphenyl-1-pentanone

C17H18O2 (254.1306728)


   

(6S,7S,11R)-2-chloro-3,7,11-trimethyl-10-methylidenespiro[5.5]undec-2-en-7-ol

(6S,7S,11R)-2-chloro-3,7,11-trimethyl-10-methylidenespiro[5.5]undec-2-en-7-ol

C15H23ClO (254.14373379999998)


   

erythro-(1,3Z,11E)-tridecatriene-7,9-diyne-5,6-diyl diacetate

erythro-(1,3Z,11E)-tridecatriene-7,9-diyne-5,6-diyl diacetate

C17H18O2 (254.1306728)


   

(3E,9Z)-6-Hydroxy-7-chloro-pentadeca-3,9-dien-1-yne|12, 13-Dihydro-(3E, 6S, 7S, 9Z, 12Z)-7-Chloro-3, 9, 12-pentadecatrien-1-yn-6-ol

(3E,9Z)-6-Hydroxy-7-chloro-pentadeca-3,9-dien-1-yne|12, 13-Dihydro-(3E, 6S, 7S, 9Z, 12Z)-7-Chloro-3, 9, 12-pentadecatrien-1-yn-6-ol

C15H23ClO (254.14373379999998)


   

Lysergol

(7-Methyl-4,6,6a,7,8,9-hexahydro-indolo[4,3-fg]quinolin-9-yl)-methanol

C16H18N2O (254.1419058)


An alkaloid of the ergoline family that occurs as a minor constituent in some species of fungi and in the morning glory family of plants. Its structure is that of ergoline with a methyl group at N-6 and a beta-hydroxymethyl substituent at C-8. D002492 - Central Nervous System Depressants > D014149 - Tranquilizing Agents > D014150 - Antipsychotic Agents D002491 - Central Nervous System Agents > D011619 - Psychotropic Drugs > D014149 - Tranquilizing Agents D002491 - Central Nervous System Agents > D002492 - Central Nervous System Depressants Origin: Plant; SubCategory_DNP: Alkaloids derived from tryptophan, Ergot alkaloids, Clavine alkaloid

   
   

5-(2-Phenylethenyl)-2-i-propyl-1,3-benzenediol

5-(2-Phenylethenyl)-2-i-propyl-1,3-benzenediol

C17H18O2 (254.1306728)


   
   
   

3-Hydroxyquinalbarbitone

3-Hydroxyquinalbarbitone

C12H18N2O4 (254.1266508)


   
   
   

1-hydroxy-1,5-diphenylpentan-3-one

1-hydroxy-1,5-diphenylpentan-3-one

C17H18O2 (254.1306728)


   
   

4-(Dimethylamino)-4-(methylamino)benzophenone

4-(Dimethylamino)-4-(methylamino)benzophenone

C16H18N2O (254.1419058)


   

19-nor-dasycarpidan-1-one|Des-N-methyl-dasycarpidon|des-N-Methyl-dasycarpon|N-Nordasycarpidone.

19-nor-dasycarpidan-1-one|Des-N-methyl-dasycarpidon|des-N-Methyl-dasycarpon|N-Nordasycarpidone.

C16H18N2O (254.1419058)


   

1-Ethyl-3-methyldiphenylurea

1-Ethyl-3-methyldiphenylurea

C16H18N2O (254.1419058)


   

1,2,3,3,4,4,5,5,6,6-Decahydro[2,3-bipyridine]-6,6-dicarboxylic acid

1,2,3,3,4,4,5,5,6,6-Decahydro[2,3-bipyridine]-6,6-dicarboxylic acid

C12H18N2O4 (254.1266508)


   

2-(methylamino)-N-phenethylbenzamide

2-(methylamino)-N-phenethylbenzamide

C16H18N2O (254.1419058)


   
   

6E,8E-Hexadecadien-10,12,14-triinsaeure-methylester|Me ester-(all-E)-6,8-Hexadecadiene-10,12,14-triynoic acid

6E,8E-Hexadecadien-10,12,14-triinsaeure-methylester|Me ester-(all-E)-6,8-Hexadecadiene-10,12,14-triynoic acid

C17H18O2 (254.1306728)


   

phenethyl 3-phenylpropionate

phenethyl 3-phenylpropionate

C17H18O2 (254.1306728)


   

2-isobutyryloxy-tridec-3E-ene-5,7,9,11-tetrayn-1-ol

2-isobutyryloxy-tridec-3E-ene-5,7,9,11-tetrayn-1-ol

C17H18O2 (254.1306728)


   

PIMONIDAZOLE

PIMONIDAZOLE

C11H18N4O3 (254.1378838)


C274 - Antineoplastic Agent > C798 - Radiosensitizing Agent D011838 - Radiation-Sensitizing Agents

   

3-hydroxy-1,5-diphenylpentan-1-one

NCGC00385514-01!3-hydroxy-1,5-diphenylpentan-1-one

C17H18O2 (254.1306728)


   

NPE_255.1491_11.6

NPE_255.1491_11.6

C16H18N2O (254.1419058)


CONFIDENCE Identification confirmed with Reference Standard synthesized at Eawag (Level 1); INTERNAL_ID 1106

   

NPE_255.1491_11.0

NPE_255.1491_11.0

C16H18N2O (254.1419058)


CONFIDENCE Tentative identification: most likely structure (Level 3); INTERNAL_ID 1107

   

1-Pentanone, 3-hydroxy-1,5-diphenyl-

1-Pentanone, 3-hydroxy-1,5-diphenyl-

C17H18O2 (254.1306728)


   
   
   

8,9,10,11-Tetrafluoro-8E,10E-dodecadien-1-ol

8,9,10,11-Tetrafluoro-8E,10E-dodecadien-1-ol

C12H18F4O (254.1293706)


   

Homoanserine

L-N-(4-aminobutyryl)-3-methyl-Histidine;N-(4-amino-1-oxobutyl)-3-methyl-L-Histidine

C11H18N4O3 (254.1378838)


   

His-val

2-(2-amino-3-methylbutanamido)-3-(1H-imidazol-5-yl)propanoic acid

C11H18N4O3 (254.1378838)


A dipeptide formed from L-histidine and L-valine residues.

   

Val-his

2-[2-amino-3-(1H-imidazol-5-yl)propanamido]-3-methylbutanoic acid

C11H18N4O3 (254.1378838)


A dipeptide formed from L-valine and L-histidine residues.

   

Furosine

2-amino-6-{[2-(furan-2-yl)-2-oxoethyl]amino}hexanoic acid

C12H18N2O4 (254.1266508)


   

Pyridosine

2-amino-6-(5-hydroxy-2-methyl-4-oxo-1,4-dihydropyridin-1-yl)hexanoic acid

C12H18N2O4 (254.1266508)


   

FEMA 3698

1-(benzyloxy)-2-methoxy-4-[(1Z)-prop-1-en-1-yl]benzene

C17H18O2 (254.1306728)


   

benzyl isoeugenol

1-(benzyloxy)-2-methoxy-4-(prop-1-en-1-yl)benzene

C17H18O2 (254.1306728)


   

Pyrraline

2-amino-6-[2-formyl-5-(hydroxymethyl)-1H-pyrrol-1-yl]hexanoic acid

C12H18N2O4 (254.1266508)


   

Setoclavine

4,6-dimethyl-6,11-diazatetracyclo[7.6.1.0^{2,7}.0^{12,16}]hexadeca-1(16),2,9,12,14-pentaen-4-ol

C16H18N2O (254.1419058)


   

FEMA 3571

1,3-Dipropylacetonyl 2-methyl-3-furyl sulfide

C14H22O2S (254.1340432)


   

FEMA 3538

2,6-dimethyl-3-[(2-methylfuran-3-yl)sulfanyl]heptan-4-one

C14H22O2S (254.1340432)


   

(S)-Argpyrimidine

2-amino-5-[(5-hydroxy-4,6-dimethylpyrimidin-2-yl)amino]pentanoic acid

C11H18N4O3 (254.1378838)


   

Aldosine

5-(6-Carboxy-2-piperidinyl)-1,2,3,4-tetrahydro-2-pyridinecarboxylic acid, 9ci

C12H18N2O4 (254.1266508)


   

4-(tert-butyl)phenyl benzoate

4-(tert-butyl)phenyl benzoate

C17H18O2 (254.1306728)


   

1-Benzoyl-4-phenyl-2-butanol

1-Benzoyl-4-phenyl-2-butanol

C17H18O2 (254.1306728)


   

2-Ethylhexanol,ethoxylate,phosphate

2-Ethylhexanol,ethoxylate,phosphate

C10H23O5P (254.1283038)


   

P-DIMETHYLAMINOBENZYLIDENE P-ANISIDINE

P-DIMETHYLAMINOBENZYLIDENE P-ANISIDINE

C16H18N2O (254.1419058)


   

3-HYDROXY-2-METHYL-1-PHENYL-3-P-TOLYL-PROPAN-1-ONE

3-HYDROXY-2-METHYL-1-PHENYL-3-P-TOLYL-PROPAN-1-ONE

C17H18O2 (254.1306728)


   

Dipentaerythritol

Dipentaerythritol

C10H22O7 (254.1365462)


   

Magnesium bis(2-ethylbutanoate)

Magnesium bis(2-ethylbutanoate)

C12H22MgO4 (254.1368512)


   

1-(4-tert-Butylphenyl)-2-pyrimidin-4-ylethanone

1-(4-tert-Butylphenyl)-2-pyrimidin-4-ylethanone

C16H18N2O (254.1419058)


   

4-N,4-N-diethylbenzene-1,4-diamine,oxalic acid

4-N,4-N-diethylbenzene-1,4-diamine,oxalic acid

C12H18N2O4 (254.1266508)


   

4-(TERT-BUTYL)-[1,1-BIPHENYL]-2-CARBOXYLIC ACID

4-(TERT-BUTYL)-[1,1-BIPHENYL]-2-CARBOXYLIC ACID

C17H18O2 (254.1306728)


   

2-{[(2-METHYLPHENYL)(PHENYL)METHOXY]METHYL}OXIRANE

2-{[(2-METHYLPHENYL)(PHENYL)METHOXY]METHYL}OXIRANE

C17H18O2 (254.1306728)


   

Phosphonic acid,P-(2,2-diethoxyethyl)-, diethyl ester

Phosphonic acid,P-(2,2-diethoxyethyl)-, diethyl ester

C10H23O5P (254.1283038)


   

N,N-Diethyl-1,4-benzenediamine ethanedioate (1:1)

N,N-Diethyl-1,4-benzenediamine ethanedioate (1:1)

C12H18N2O4 (254.1266508)


   

Ethyl 3,3-diphenylpropanoate

Ethyl 3,3-diphenylpropanoate

C17H18O2 (254.1306728)


   

4-(2-methoxyphenyl)-2,3,4,5-tetrahydro-1H-1,5-benzodiazepine

4-(2-methoxyphenyl)-2,3,4,5-tetrahydro-1H-1,5-benzodiazepine

C16H18N2O (254.1419058)


   
   

Chloro(dimethyl)(6-phenylhexyl)silane

Chloro(dimethyl)(6-phenylhexyl)silane

C14H23ClSi (254.1257468)


   

1-(cyclopentylmethyl)piperidin-4-amine,dihydrochloride

1-(cyclopentylmethyl)piperidin-4-amine,dihydrochloride

C11H24Cl2N2 (254.13164439999997)


   

2-(2-(DIFLUOROMETHYL)PHENYL)-4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLANE

2-(2-(DIFLUOROMETHYL)PHENYL)-4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLANE

C13H17BF2O2 (254.12895960000003)


   

tert-butyl N-[2-amino-2-(2-fluorophenyl)ethyl]carbamate

tert-butyl N-[2-amino-2-(2-fluorophenyl)ethyl]carbamate

C13H19FN2O2 (254.14304860000001)


   

N-[4-(BENZYLAMINOMETHYL)PHENYL]ACETAMIDE

N-[4-(BENZYLAMINOMETHYL)PHENYL]ACETAMIDE

C16H18N2O (254.1419058)


   

[5-(TERT-BUTYL)-2-HYDROXYPHENYL](PHENYL)METHANONE

[5-(TERT-BUTYL)-2-HYDROXYPHENYL](PHENYL)METHANONE

C17H18O2 (254.1306728)


   

1H-PYRROLE-2-CARBOXYLIC ACID, 4-[[(1,1-DIMETHYLETHOXY)CARBONYL]AMINO]-1-METHYL-, METHYL ESTER

1H-PYRROLE-2-CARBOXYLIC ACID, 4-[[(1,1-DIMETHYLETHOXY)CARBONYL]AMINO]-1-METHYL-, METHYL ESTER

C12H18N2O4 (254.1266508)


   

Tapinarof

3,5-Dihydroxy-4-isopropylstilbene

C17H18O2 (254.1306728)


C78272 - Agent Affecting Nervous System > C241 - Analgesic Agent > C2198 - Nonnarcotic Analgesic

   

DL-3-(3,4-Dimethoxyphenyl)-2-methyl-2-hydrazine propionic acid

DL-3-(3,4-Dimethoxyphenyl)-2-methyl-2-hydrazine propionic acid

C12H18N2O4 (254.1266508)


   

tert-Butyl 4,5-dimethoxypyridin-3-ylcarbamate

tert-Butyl 4,5-dimethoxypyridin-3-ylcarbamate

C12H18N2O4 (254.1266508)


   

tert-Butyl 2,6-diiodopyridin-3-yl carbonate

tert-Butyl 2,6-diiodopyridin-3-yl carbonate

C12H18N2O4 (254.1266508)


   

5,6,7,8-tetradeuterio-2-methyl-3-(2-methylphenyl)quinazolin-4-one

5,6,7,8-tetradeuterio-2-methyl-3-(2-methylphenyl)quinazolin-4-one

C16H10D4N2O (254.13571611199998)


   

4-tert-Butylbiphenyl-3-carboxylic acid

4-tert-Butylbiphenyl-3-carboxylic acid

C17H18O2 (254.1306728)


   

3-(4-tert-butylphenoxy)benzaldehyde

3-(4-tert-butylphenoxy)benzaldehyde

C17H18O2 (254.1306728)


   

4-(4-methoxyphenyl)-2,3,4,5-tetrahydro-1H-1,5-benzodiazepine

4-(4-methoxyphenyl)-2,3,4,5-tetrahydro-1H-1,5-benzodiazepine

C16H18N2O (254.1419058)


   

(4-TERT-BUTOXY-PHENYL)-METHANOL

(4-TERT-BUTOXY-PHENYL)-METHANOL

C17H18O2 (254.1306728)


   

4-(4-n-butylphenyl)benzoic acid

4-(4-n-butylphenyl)benzoic acid

C17H18O2 (254.1306728)


   

4-[(4-butylphenyl)hydrazinylidene]cyclohexa-2,5-dien-1-one

4-[(4-butylphenyl)hydrazinylidene]cyclohexa-2,5-dien-1-one

C16H18N2O (254.1419058)


   

n-boc-cis-4-cyano-l-proline methyl ester

n-boc-cis-4-cyano-l-proline methyl ester

C12H18N2O4 (254.1266508)


   

1-[4-(3-ISOPROPYL-PHENOXY)-PHENYL]-ETHANONE

1-[4-(3-ISOPROPYL-PHENOXY)-PHENYL]-ETHANONE

C17H18O2 (254.1306728)


   

1-[4-(3-METHYL-5-ETHYL-PHENOXY)-PHENYL]-ETHANONE

1-[4-(3-METHYL-5-ETHYL-PHENOXY)-PHENYL]-ETHANONE

C17H18O2 (254.1306728)


   

1-[4-(4-ISOPROPYL-PHENOXY)-PHENYL]-ETHANONE

1-[4-(4-ISOPROPYL-PHENOXY)-PHENYL]-ETHANONE

C17H18O2 (254.1306728)


   

1-[4-(4-PROPYL-PHENOXY)-PHENYL]-ETHANONE

1-[4-(4-PROPYL-PHENOXY)-PHENYL]-ETHANONE

C17H18O2 (254.1306728)


   

3-(TERT-BUTYL)-[1,1-BIPHENYL]-3-CARBOXYLIC ACID

3-(TERT-BUTYL)-[1,1-BIPHENYL]-3-CARBOXYLIC ACID

C17H18O2 (254.1306728)


   

Diethyl 2-propyl-1H-imidazole-4,5-dicarboxylate

Diethyl 2-propyl-1H-imidazole-4,5-dicarboxylate

C12H18N2O4 (254.1266508)


   

4-(3-methoxyphenyl)-2,3,4,5-tetrahydro-1H-1,5-benzodiazepine

4-(3-methoxyphenyl)-2,3,4,5-tetrahydro-1H-1,5-benzodiazepine

C16H18N2O (254.1419058)


   

4-tert-Butyl[1,1-biphenyl]-4-carboxylic acid

4-tert-Butyl[1,1-biphenyl]-4-carboxylic acid

C17H18O2 (254.1306728)


   

Benzamide,3-amino-N-(2,4-dimethylphenyl)-4-methyl-

Benzamide,3-amino-N-(2,4-dimethylphenyl)-4-methyl-

C16H18N2O (254.1419058)


   

(PHENYLTHIO)ACETICACID

(PHENYLTHIO)ACETICACID

C14H23ClSi (254.1257468)


   

9,9-Bis(methoxymethyl)-9H-fluorene

9,9-Bis(methoxymethyl)-9H-fluorene

C17H18O2 (254.1306728)


   

Boc-trans-4-cyano-L-proline methyl ester

Boc-trans-4-cyano-L-proline methyl ester

C12H18N2O4 (254.1266508)


   

tert-butyl 3-methoxy-5,6-dihydro-[1,2,4]triazolo[4,3-a]pyrazine-7(8H)-carboxylate

tert-butyl 3-methoxy-5,6-dihydro-[1,2,4]triazolo[4,3-a]pyrazine-7(8H)-carboxylate

C11H18N4O3 (254.1378838)


   

2-tert-Butylbiphenyl-3-carboxylic acid

2-tert-Butylbiphenyl-3-carboxylic acid

C17H18O2 (254.1306728)


   

2-Amino-5-methylthiophene-3-carbonitrile

2-Amino-5-methylthiophene-3-carbonitrile

C13H19FN2O2 (254.14304860000001)


   

Benzene,2-methoxy-1-(phenylmethoxy)-4-(2-propen-1-yl)-

Benzene,2-methoxy-1-(phenylmethoxy)-4-(2-propen-1-yl)-

C17H18O2 (254.1306728)


   

2,2-diphenylpentanoic acid

2,2-diphenylpentanoic acid

C17H18O2 (254.1306728)


   

2-(5-AMINO-[1,3,4]OXADIAZOL-2-YL)-PYRROLIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER

2-(5-AMINO-[1,3,4]OXADIAZOL-2-YL)-PYRROLIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER

C11H18N4O3 (254.1378838)


   

2-(4-(DIFLUOROMETHYL)PHENYL)-4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLANE

2-(4-(DIFLUOROMETHYL)PHENYL)-4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLANE

C13H17BF2O2 (254.12895960000003)


   

CYCLOPROPYL 4-METHOXYDIPHENYLCARBINOL

CYCLOPROPYL 4-METHOXYDIPHENYLCARBINOL

C17H18O2 (254.1306728)


   

tert-butyl 7,9-dioxo-2,6-diazaspiro[3.5]nonane-2-carboxylate

tert-butyl 7,9-dioxo-2,6-diazaspiro[3.5]nonane-2-carboxylate

C12H18N2O4 (254.1266508)


   

3-Trifluoromethyl-piperazine-1-carboxylic acid tert-butyl ester

3-Trifluoromethyl-piperazine-1-carboxylic acid tert-butyl ester

C10H17F3N2O2 (254.1242058)


   

tert-butyl 2-(trifluoromethyl)piperazine-1-carboxylate

tert-butyl 2-(trifluoromethyl)piperazine-1-carboxylate

C10H17F3N2O2 (254.1242058)


   

3,4-DIFLUORO-2-METHYLPHENYL BORONIC ACID PINACOL ESTER

3,4-DIFLUORO-2-METHYLPHENYL BORONIC ACID PINACOL ESTER

C13H17BF2O2 (254.12895960000003)


   

N-Cyclopropyl-4-(4-piperidinyl)-2-pyriMidinaMine hydrochloride

N-Cyclopropyl-4-(4-piperidinyl)-2-pyriMidinaMine hydrochloride

C12H19ClN4 (254.12981639999998)


   

2-(3-(difluoromethyl)phenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

2-(3-(difluoromethyl)phenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

C13H17BF2O2 (254.12895960000003)


   

Tris(1-methylethyl)(trifluoroacetyl)silane

Tris(1-methylethyl)(trifluoroacetyl)silane

C11H21F3OSi (254.1313692)


   

4-METHYL-1,4-BIPIPERIDINE DIHYDROCHLORIDE

4-METHYL-1,4-BIPIPERIDINE DIHYDROCHLORIDE

C11H24Cl2N2 (254.13164439999997)


   

5-(4-BIPHENYLYL)VALERIC ACID

5-(4-BIPHENYLYL)VALERIC ACID

C17H18O2 (254.1306728)


   
   

Chloro(diisopropyl)(2-phenylethyl)silane

Chloro(diisopropyl)(2-phenylethyl)silane

C14H23ClSi (254.1257468)


   

4-cyano-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-4-carboxylic acid

4-cyano-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-4-carboxylic acid

C12H18N2O4 (254.1266508)


   

9H-Fluorene-9,9-diethanol

9H-Fluorene-9,9-diethanol

C17H18O2 (254.1306728)


   

N-(4-amino-m-tolyl)-N-ethylbenzamide

N-(4-amino-m-tolyl)-N-ethylbenzamide

C16H18N2O (254.1419058)


   
   

BENZOIN ISOPROPYL ETHER

BENZOIN ISOPROPYL ETHER

C17H18O2 (254.1306728)


   

6,8-dimethyl-2-pyrrolidin-1-ylquinoline-3-carbaldehyde

6,8-dimethyl-2-pyrrolidin-1-ylquinoline-3-carbaldehyde

C16H18N2O (254.1419058)


   

2-(3,5-dimethoxyphenyl)propan-2-yl N-aminocarbamate

2-(3,5-dimethoxyphenyl)propan-2-yl N-aminocarbamate

C12H18N2O4 (254.1266508)


   
   

N-(2-quinolinyl)cyclohexanecarboxamide

N-(2-quinolinyl)cyclohexanecarboxamide

C16H18N2O (254.1419058)


   

Argpyrimidine

Argpyrimidine

C11H18N4O3 (254.1378838)


A member of the class of hydroxypyrimidines obtained by cyclocondensation of L-arginine and methylglyoxal; a methyl glyoxal-derived advanced glycation end-product (AGE) in familial amyloidotic polyneuropathy and human cancers.

   

N-Methyl-N-[3-phenyl-3-(2-pyridinyl)propyl]formamide

N-Methyl-N-[3-phenyl-3-(2-pyridinyl)propyl]formamide

C16H18N2O (254.1419058)


   

N-[3-phenyl-3-(pyridin-2-yl)propyl]acetamide

N-[3-phenyl-3-(pyridin-2-yl)propyl]acetamide

C16H18N2O (254.1419058)


   

3,6-Diisobutylpyrazine-2,5-diolate 1,4-dioxide

3,6-Diisobutylpyrazine-2,5-diolate 1,4-dioxide

C12H18N2O4-2 (254.1266508)


   

valylhistidine

(2S)-2-[[(2S)-2-amino-3-methylbutanoyl]amino]-3-(1H-imidazol-5-yl)propanoic acid

C11H18N4O3 (254.1378838)


   

N-(4-anilinophenyl)-2-methylpropanamide

N-(4-anilinophenyl)-2-methylpropanamide

C16H18N2O (254.1419058)


   

1-(5-phenyl-2-pyrrolidin-1-yl-1H-pyrrol-3-yl)ethanone

1-(5-phenyl-2-pyrrolidin-1-yl-1H-pyrrol-3-yl)ethanone

C16H18N2O (254.1419058)


   

(2R/S)-2-[4-(2-Fluoro-1-hydroxy-2-methylpropyl)-phenyl]-propionic acid methyl ester

(2R/S)-2-[4-(2-Fluoro-1-hydroxy-2-methylpropyl)-phenyl]-propionic acid methyl ester

C14H19FO3 (254.1318156)


   

(2R,3S,4S)-3-[4-(1-cyclopentenyl)phenyl]-4-(hydroxymethyl)-2-azetidinecarbonitrile

(2R,3S,4S)-3-[4-(1-cyclopentenyl)phenyl]-4-(hydroxymethyl)-2-azetidinecarbonitrile

C16H18N2O (254.1419058)


   

(2R,3R,4R)-3-[4-(1-cyclopentenyl)phenyl]-4-(hydroxymethyl)-2-azetidinecarbonitrile

(2R,3R,4R)-3-[4-(1-cyclopentenyl)phenyl]-4-(hydroxymethyl)-2-azetidinecarbonitrile

C16H18N2O (254.1419058)


   

(2S,3R,4R)-3-[4-(1-cyclopentenyl)phenyl]-4-(hydroxymethyl)-2-azetidinecarbonitrile

(2S,3R,4R)-3-[4-(1-cyclopentenyl)phenyl]-4-(hydroxymethyl)-2-azetidinecarbonitrile

C16H18N2O (254.1419058)


   

(2S,3S,4S)-3-[4-(1-cyclopentenyl)phenyl]-4-(hydroxymethyl)-2-azetidinecarbonitrile

(2S,3S,4S)-3-[4-(1-cyclopentenyl)phenyl]-4-(hydroxymethyl)-2-azetidinecarbonitrile

C16H18N2O (254.1419058)


   

a 8-Methylmenaquinone

a 8-Methylmenaquinone

C17H18O2 (254.1306728)


   

N-(3-phenylpropyl)-7H-purin-1-ium-6-amine

N-(3-phenylpropyl)-7H-purin-1-ium-6-amine

C14H16N5+ (254.1405636)


   

4-Isopropylbenzyl benzoate

4-Isopropylbenzyl benzoate

C17H18O2 (254.1306728)


   

5-(Para-phenoxyphenyl)pentanal

5-(Para-phenoxyphenyl)pentanal

C17H18O2 (254.1306728)


   

midodrine

midodrine

C12H18N2O4 (254.1266508)


C - Cardiovascular system > C01 - Cardiac therapy > C01C - Cardiac stimulants excl. cardiac glycosides > C01CA - Adrenergic and dopaminergic agents D018373 - Peripheral Nervous System Agents > D001337 - Autonomic Agents > D013566 - Sympathomimetics C78272 - Agent Affecting Nervous System > C29747 - Adrenergic Agent > C87053 - Adrenergic Agonist D018377 - Neurotransmitter Agents > D018663 - Adrenergic Agents > D000322 - Adrenergic Agonists D002317 - Cardiovascular Agents > D014662 - Vasoconstrictor Agents Midodrine is an α1-receptor agonist, for the treatment of dysautonomia and orthostatic hypotension.

   

Elymoclavine

Ergoline-8-methanol,8,9-didehydro-6-methyl-

C16H18N2O (254.1419058)


   

pulcherriminate(2-)

pulcherriminate(2-)

C12H18N2O4 (254.1266508)


An organic anion obtained by deprotonation of the two hydroxy groups of pulcherriminic acid; major species at pH 7.3.

   

Isoeugenol benzyl ether

Isoeugenol benzyl ether

C17H18O2 (254.1306728)


   

4-((2-methyl-3-furyl)thio)-5-nonanone

4-((2-methyl-3-furyl)thio)-5-nonanone

C14H22O2S (254.1340432)


   

2,6-Dimethyl-3-((2-methyl-3-furyl)thio)-4-heptanone

2,6-Dimethyl-3-((2-methyl-3-furyl)thio)-4-heptanone

C14H22O2S (254.1340432)


   
   
   

5-(6-carboxypiperidin-2-yl)-1,2,3,4-tetrahydropyridine-2-carboxylic acid

5-(6-carboxypiperidin-2-yl)-1,2,3,4-tetrahydropyridine-2-carboxylic acid

C12H18N2O4 (254.1266508)


   
   

1-(L-norleucin-6-yl)pyrraline

1-(L-norleucin-6-yl)pyrraline

C12H18N2O4 (254.1266508)


An N-substituted pyrraline formed via Maillard reaction of L-lysine with glucose.

   

[(4s,7r)-6-methyl-6,11-diazatetracyclo[7.6.1.0²,⁷.0¹²,¹⁶]hexadeca-1(16),2,9,12,14-pentaen-4-yl]methanol

[(4s,7r)-6-methyl-6,11-diazatetracyclo[7.6.1.0²,⁷.0¹²,¹⁶]hexadeca-1(16),2,9,12,14-pentaen-4-yl]methanol

C16H18N2O (254.1419058)


   

(3r,4r)-3-[(1z)-buta-1,3-dien-1-yl]-4-[(5e)-hept-5-en-1,3-diyn-1-yl]hexane-2,5-dione

(3r,4r)-3-[(1z)-buta-1,3-dien-1-yl]-4-[(5e)-hept-5-en-1,3-diyn-1-yl]hexane-2,5-dione

C17H18O2 (254.1306728)


   

(3s,6r)-8-chloro-1,1,9-trimethyl-5-methylidenespiro[5.5]undec-8-en-3-ol

(3s,6r)-8-chloro-1,1,9-trimethyl-5-methylidenespiro[5.5]undec-8-en-3-ol

C15H23ClO (254.14373379999998)


   

5-methoxy-10,10-dimethyl-8,12-diazatetracyclo[6.6.1.0²,⁷.0¹¹,¹⁵]pentadeca-1(15),2,4,6,11-pentaene

5-methoxy-10,10-dimethyl-8,12-diazatetracyclo[6.6.1.0²,⁷.0¹¹,¹⁵]pentadeca-1(15),2,4,6,11-pentaene

C16H18N2O (254.1419058)


   

9,10-dihydro-2-hydroxy-5-(hydroxymethyl)-1,7-dimethylphenanthrene

NA

C17H18O2 (254.1306728)


{"Ingredient_id": "HBIN013933","Ingredient_name": "9,10-dihydro-2-hydroxy-5-(hydroxymethyl)-1,7-dimethylphenanthrene","Alias": "NA","Ingredient_formula": "C17H18O2","Ingredient_Smile": "NA","Ingredient_weight": "254.32","OB_score": "NA","CAS_id": "199597-53-0","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "7308","PubChem_id": "NA","DrugBank_id": "NA"}

   

(3e,6s,7s,9z)-7-chloropentadeca-3,9-dien-1-yn-6-ol

(3e,6s,7s,9z)-7-chloropentadeca-3,9-dien-1-yn-6-ol

C15H23ClO (254.14373379999998)


   
   

5-(hydroxymethyl)-1,7-dimethyl-9,10-dihydrophenanthren-2-ol

5-(hydroxymethyl)-1,7-dimethyl-9,10-dihydrophenanthren-2-ol

C17H18O2 (254.1306728)


   

3,6,6,9-tetramethylbenzo[c]chromen-1-ol

3,6,6,9-tetramethylbenzo[c]chromen-1-ol

C17H18O2 (254.1306728)


   

2-methoxy-7,8-dimethyl-9,10-dihydrophenanthren-3-ol

2-methoxy-7,8-dimethyl-9,10-dihydrophenanthren-3-ol

C17H18O2 (254.1306728)


   

(3z,6s,7s,9z)-7-chloropentadeca-3,9-dien-1-yn-6-ol

(3z,6s,7s,9z)-7-chloropentadeca-3,9-dien-1-yn-6-ol

C15H23ClO (254.14373379999998)


   

5,7-dimethyl-4-oxa-7,12-diazapentacyclo[8.6.1.0²,⁸.0³,⁵.0¹³,¹⁷]heptadeca-1(17),10,13,15-tetraene

5,7-dimethyl-4-oxa-7,12-diazapentacyclo[8.6.1.0²,⁸.0³,⁵.0¹³,¹⁷]heptadeca-1(17),10,13,15-tetraene

C16H18N2O (254.1419058)


   

methyl (6e,8e)-hexadeca-6,8-dien-10,12,14-triynoate

methyl (6e,8e)-hexadeca-6,8-dien-10,12,14-triynoate

C17H18O2 (254.1306728)


   

8-chloro-1,5,9-trimethyl-4-methylidenespiro[5.5]undec-8-en-1-ol

8-chloro-1,5,9-trimethyl-4-methylidenespiro[5.5]undec-8-en-1-ol

C15H23ClO (254.14373379999998)


   
   

3-(2-pentyl-1,3-oxazol-5-yl)-1h-indole

3-(2-pentyl-1,3-oxazol-5-yl)-1h-indole

C16H18N2O (254.1419058)


   

7-chloropentadeca-3,9-dien-1-yn-6-ol

7-chloropentadeca-3,9-dien-1-yn-6-ol

C15H23ClO (254.14373379999998)


   

(2s)-2-{[(2s)-2-amino-1-hydroxy-3-methylbutylidene]amino}-3-(3h-imidazol-4-yl)propanoic acid

(2s)-2-{[(2s)-2-amino-1-hydroxy-3-methylbutylidene]amino}-3-(3h-imidazol-4-yl)propanoic acid

C11H18N4O3 (254.1378838)


   

3,6-bis(2-methylpropyl)-1-oxo-1h-1λ⁵-pyrazin-1-ylium-2,4,5-tris(olate)

3,6-bis(2-methylpropyl)-1-oxo-1h-1λ⁵-pyrazin-1-ylium-2,4,5-tris(olate)

[C12H18N2O4]2- (254.1266508)


   

(1s,5r,6s)-8-chloro-1,5,9-trimethyl-4-methylidenespiro[5.5]undec-8-en-1-ol

(1s,5r,6s)-8-chloro-1,5,9-trimethyl-4-methylidenespiro[5.5]undec-8-en-1-ol

C15H23ClO (254.14373379999998)


   

8-chloro-1,1,9-trimethyl-5-methylidenespiro[5.5]undec-8-en-3-ol

8-chloro-1,1,9-trimethyl-5-methylidenespiro[5.5]undec-8-en-3-ol

C15H23ClO (254.14373379999998)


   

3-(buta-1,3-dien-1-yl)-4-(hept-5-en-1,3-diyn-1-yl)hexane-2,5-dione

3-(buta-1,3-dien-1-yl)-4-(hept-5-en-1,3-diyn-1-yl)hexane-2,5-dione

C17H18O2 (254.1306728)


   

methyl hexadeca-6,8-dien-10,12,14-triynoate

methyl hexadeca-6,8-dien-10,12,14-triynoate

C17H18O2 (254.1306728)


   

2-(methylamino)-n-(2-phenylethyl)benzenecarboximidic acid

2-(methylamino)-n-(2-phenylethyl)benzenecarboximidic acid

C16H18N2O (254.1419058)