Exact Mass: 256.1383

Exact Mass Matches: 256.1383

Found 179 metabolites which its exact mass value is equals to given mass value 256.1383, within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error 0.001 dalton.

3,3-Dimethylbisphenol A

2,2-Bis(4-hydroxy-3-methylphenyl)propane

C17H20O2 (256.1463)


   

3,3-Bis(4-hydroxyphenyl)pentane

4,4-(1-Ethylpropane-1,1,-diyl)diphenol

C17H20O2 (256.1463)


   

Decarbamoylsaxitoxin

4-(hydroxymethyl)-2,6-diimino-hexahydro-1H-pyrrolo[1,2-c]purine-10,10-diol

C9H16N6O3 (256.1284)


D009676 - Noxae > D011042 - Poisons > D008978 - Mollusk Venoms D009676 - Noxae > D011042 - Poisons > D008387 - Marine Toxins Decarbamoylsaxitoxin is isolated from various shellfish. D009676 - Noxae > D011042 - Poisons > D014688 - Venoms Isolated from various shellfish

   

Pulcherriminic acid

Pulcherriminic acid

C12H20N2O4 (256.1423)


A pyrazine N-oxide that is pyrazine-1,4-dioxide substituted at positions 2 and 5 by hydroxy groups and at positions 3 and 6 by isobutyl groups. Formed by oxidative aromatisation of cyclo(L-leucyl-L-leucyl).

   

2-[4-(3-Hydroxypropyl)-2-methoxyphenoxy]-1,3-propanediol

2-[4-(3-hydroxypropyl)-2-methoxyphenoxy]propane-1,3-diol

C13H20O5 (256.1311)


2-[4-(3-Hydroxypropyl)-2-methoxyphenoxy]-1,3-propanediol is found in alcoholic beverages. 2-[4-(3-Hydroxypropyl)-2-methoxyphenoxy]-1,3-propanediol is a constituent of Vitis vinifera cv. Gewurztraminer. Constituent of Vitis vinifera cv. Gewurztraminer. 2-[4-(3-Hydroxypropyl)-2-methoxyphenoxy]-1,3-propanediol is found in alcoholic beverages.

   

1-Methoxy-1-(2,4,5-trimethoxyphenyl)-2-propanol

1-Methoxy-1-(2,4,5-trimethoxyphenyl)-2-propanol

C13H20O5 (256.1311)


1-Methoxy-1-(2,4,5-trimethoxyphenyl)-2-propanol is found in herbs and spices. 1-Methoxy-1-(2,4,5-trimethoxyphenyl)-2-propanol is a constituent of Acorus calamus (sweet flag)

   

Falcarindione

(9E)-heptadeca-1,9-dien-4,6-diyne-3,8-dione

C17H20O2 (256.1463)


Isolated from roots of Carum carvi (caraway). Falcarindione is found in caraway, fats and oils, and herbs and spices. Falcarindione is found in caraway. Falcarindione is isolated from roots of Carum carvi (caraway).

   

4,4'-Methylenebis(2,6-dimethylphenol)

4-[(4-hydroxy-3,5-dimethylphenyl)methyl]-2,6-dimethylphenol

C17H20O2 (256.1463)


   

1,8-Dihydroaplysinopsin

1,8-Dihydroaplysinopsin

C14H16N4O (256.1324)


   
   

CHEMBL490375

CHEMBL490375

C17H20O2 (256.1463)


   

17-Hydroxy-heptadeca-7t,9t,15t-trien-11,13-diin-4-on|17-hydroxy-heptadeca-7t,9t,15t-triene-11,13-diyn-4-one|Bupleuronol

17-Hydroxy-heptadeca-7t,9t,15t-trien-11,13-diin-4-on|17-hydroxy-heptadeca-7t,9t,15t-triene-11,13-diyn-4-one|Bupleuronol

C17H20O2 (256.1463)


   

1-(2,4,5-Trimethoxyphenyl)-1-hydroxy-2-methoxypropane|2,2,4,5,-Tetra-Me ether-1-(2,4,5-Trihydroxyphenyl)-1,2-propanediol

1-(2,4,5-Trimethoxyphenyl)-1-hydroxy-2-methoxypropane|2,2,4,5,-Tetra-Me ether-1-(2,4,5-Trihydroxyphenyl)-1,2-propanediol

C13H20O5 (256.1311)


   

(+-)-dehydrofalcarinolone|8-hydroxy-heptadeca-1,9c,16-triene-4,6-diyn-3-one

(+-)-dehydrofalcarinolone|8-hydroxy-heptadeca-1,9c,16-triene-4,6-diyn-3-one

C17H20O2 (256.1463)


   

8,N2,N6,N6-tetramethyl-1H-cyclohepta[1,2-d;4,5-d]diimidazole-2,6-diamine|Epizoanthoxanthin A

8,N2,N6,N6-tetramethyl-1H-cyclohepta[1,2-d;4,5-d]diimidazole-2,6-diamine|Epizoanthoxanthin A

C13H16N6 (256.1436)


   

(all-E)-7,9,15-Heptadecatriene-11,13-diynoic acid

(all-E)-7,9,15-Heptadecatriene-11,13-diynoic acid

C17H20O2 (256.1463)


   

Pachysontol

Pachysontol

C13H20O5 (256.1311)


   

Palyzoanthoxanthin A

Palyzoanthoxanthin A

C13H16N6 (256.1436)


   

6E,8E,14E-Hexadecatrien-10,12-diinsaeure-methylester|Me ester-(all-E)-6,8,14-Hexadecatetrien-10,12-diynoic acid

6E,8E,14E-Hexadecatrien-10,12-diinsaeure-methylester|Me ester-(all-E)-6,8,14-Hexadecatetrien-10,12-diynoic acid

C17H20O2 (256.1463)


   

Zoanthoxanthine

Zoanthoxanthine

C13H16N6 (256.1436)


   

Zoanthoxanthin

Zoanthoxanthin

C13H16N6 (256.1436)


   

Paragracine

Paragracine

C13H16N6 (256.1436)


   

(S)-6-[(S)-1-Acetoxypentyl]-5,6-dihydro-4-methoxy-2H-pyran-2-one

(S)-6-[(S)-1-Acetoxypentyl]-5,6-dihydro-4-methoxy-2H-pyran-2-one

C13H20O5 (256.1311)


   

Ac-(E,E,E)-5,7,13-Pentadecatriene-9,11-diyn-1-ol

Ac-(E,E,E)-5,7,13-Pentadecatriene-9,11-diyn-1-ol

C17H20O2 (256.1463)


   

acide (methyl-3 hydroxy-3 butyl)-5 propyl-5 barbiturique

acide (methyl-3 hydroxy-3 butyl)-5 propyl-5 barbiturique

C12H20N2O4 (256.1423)


   

2,6-diamino-2,3,4,6-tetradeoxy-glycero-hex-4-enopyranose-Et glycoside, 2,6-di-N-Ac

2,6-diamino-2,3,4,6-tetradeoxy-glycero-hex-4-enopyranose-Et glycoside, 2,6-di-N-Ac

C12H20N2O4 (256.1423)


   

(2RS,4SR)-6-(3-hydroxy-4-methoxyphenyl)hexane-1,2,4-triol|debilitriol

(2RS,4SR)-6-(3-hydroxy-4-methoxyphenyl)hexane-1,2,4-triol|debilitriol

C13H20O5 (256.1311)


   

SCHEMBL12555516

SCHEMBL12555516

C12H20N2O4 (256.1423)


   

dendrodolide M

dendrodolide M

C13H20O5 (256.1311)


   

Galanthamine

Galanthamine

C17H20O2 (256.1463)


   
   

dendrodolide A

dendrodolide A

C13H20O5 (256.1311)


   

SCHEMBL16661546

SCHEMBL16661546

C17H20O2 (256.1463)


   

Bis(4-ethoxyphenyl)methane

Bis(4-ethoxyphenyl)methane

C17H20O2 (256.1463)


   

(1,8E,12E,14Z)-heptadecatetraene-4,6-diyne-3,11-diol

(1,8E,12E,14Z)-heptadecatetraene-4,6-diyne-3,11-diol

C17H20O2 (256.1463)


   

negombatoperoxide B

negombatoperoxide B

C13H20O5 (256.1311)


   

1,4,N8,N8-tetramethyl-1H-cyclohepta[1,2-d;3,4-d]diimidazole-2,8-diamine|Trimethuylpseudozoanthooxanthin A|zoanthoxanthin 4

1,4,N8,N8-tetramethyl-1H-cyclohepta[1,2-d;3,4-d]diimidazole-2,8-diamine|Trimethuylpseudozoanthooxanthin A|zoanthoxanthin 4

C13H16N6 (256.1436)


   

Homopseudozoanthoxanthin

Homopseudozoanthoxanthin

C13H16N6 (256.1436)


   

(all-E)-17-Hydroxy-5,7,9-heptadecatriene-11,13-diyn-4-one|17-Hydroxy-heptadeca-5t,7t,9t-trien-11,13-diin-4-on|17-hydroxy-heptadeca-5t,7t,9t-triene-11,13-diyn-4-one

(all-E)-17-Hydroxy-5,7,9-heptadecatriene-11,13-diyn-4-one|17-Hydroxy-heptadeca-5t,7t,9t-trien-11,13-diin-4-on|17-hydroxy-heptadeca-5t,7t,9t-triene-11,13-diyn-4-one

C17H20O2 (256.1463)


   

cucubalactone

cucubalactone

C13H20O5 (256.1311)


   

Stilbostemin M

Stilbostemin M

C17H20O2 (256.1463)


   

3-(3,4,5-Trimethoxyphenyl)-3-methoxy-1-propanol

3-(3,4,5-Trimethoxyphenyl)-3-methoxy-1-propanol

C13H20O5 (256.1311)


   

(S)-4,6,9-trimethyl-5,6,7,8-tetrahydrophenanthrene-1,2-diol|henryin A

(S)-4,6,9-trimethyl-5,6,7,8-tetrahydrophenanthrene-1,2-diol|henryin A

C17H20O2 (256.1463)


   

(-)-erythro-1,5-diphenylpentane-1,3-diol|(1S,3R)-1,5-Diphenyl-1,3-pentanediol

(-)-erythro-1,5-diphenylpentane-1,3-diol|(1S,3R)-1,5-Diphenyl-1,3-pentanediol

C17H20O2 (256.1463)


   

8,10-diapocarotene-8,10-dial

8,10-diapocarotene-8,10-dial

C17H20O2 (256.1463)


   

1-Methoxy-1-(2,4,5-trimethoxyphenyl)-2-propanol

1-Methoxy-1-(2,4,5-trimethoxyphenyl)-2-propanol

C13H20O5 (256.1311)


   

Falcarindione

(9E)-heptadeca-1,9-dien-4,6-diyne-3,8-dione

C17H20O2 (256.1463)


   

2-[4-(3-hydroxypropyl)-2-methoxyphenoxy]propane-1,3-diol

2-[4-(3-hydroxypropyl)-2-methoxyphenoxy]propane-1,3-diol

C13H20O5 (256.1311)


   

Canangalia I

methyl (2E,6R)-6-hydroxy-3-methyl-6-(2-methyl-5-oxotetrahydrofuran-2-yl) hex-2-enoate

C13H20O5 (256.1311)


   

4-[2-(4-hydroxyphenyl)pentan-2-yl]phenol

4-[2-(4-hydroxyphenyl)pentan-2-yl]phenol

C17H20O2 (256.1463)


   

TRANS-4-PROPYLCYCLOHEXYL 3,4,5-TRIFLUOROBENZENE

TRANS-4-PROPYLCYCLOHEXYL 3,4,5-TRIFLUOROBENZENE

C15H19F3 (256.1439)


   

diethyl 2-(cyclopentanecarbonyl)propanedioate

diethyl 2-(cyclopentanecarbonyl)propanedioate

C13H20O5 (256.1311)


   

4-(4-methylpiperazin-1-yl)quinazoline-6-carbaldehyde

4-(4-methylpiperazin-1-yl)quinazoline-6-carbaldehyde

C14H16N4O (256.1324)


   

6-(3-hydroxy-2,2-dimethylpropoxy)carbonylcyclohex-3-ene-1-carboxylic acid

6-(3-hydroxy-2,2-dimethylpropoxy)carbonylcyclohex-3-ene-1-carboxylic acid

C13H20O5 (256.1311)


   

2,2-Dibenzyl-1,3-propanediol

2,2-Dibenzyl-1,3-propanediol

C17H20O2 (256.1463)


   

Diethyl 2-(2-oxocyclohexyl)malonate

Diethyl 2-(2-oxocyclohexyl)malonate

C13H20O5 (256.1311)


   

2-Amino-7-benzyl-5,6,7,8-tetrahydro-3H-pyrido[3,4-d]pyrimidin-4-one

2-Amino-7-benzyl-5,6,7,8-tetrahydro-3H-pyrido[3,4-d]pyrimidin-4-one

C14H16N4O (256.1324)


   

benzoic acid,2,2-diethoxyethanol

benzoic acid,2,2-diethoxyethanol

C13H20O5 (256.1311)


   

Ethoxazene

1,3-Benzenediamine,4-[2-(4-ethoxyphenyl)diazenyl]-

C14H16N4O (256.1324)


C78272 - Agent Affecting Nervous System > C241 - Analgesic Agent

   
   

4-[1-(4-hydroxyphenyl)-2,2-dimethylpropyl]phenol

4-[1-(4-hydroxyphenyl)-2,2-dimethylpropyl]phenol

C17H20O2 (256.1463)


   

6-PHENYL-5-(PIPERAZIN-1-YL)PYRIDAZIN-3(2H)-ONE

6-PHENYL-5-(PIPERAZIN-1-YL)PYRIDAZIN-3(2H)-ONE

C14H16N4O (256.1324)


   

6-Amino-2-Boc-2-azaspiro[3.3]heptane-6-carboxylic acid

6-Amino-2-Boc-2-azaspiro[3.3]heptane-6-carboxylic acid

C12H20N2O4 (256.1423)


   

6-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)quinoxaline

6-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)quinoxaline

C14H17BN2O2 (256.1383)


   

Dimethyl-bisphenol A

Dimethyl-bisphenol A

C17H20O2 (256.1463)


Dimethyl-bisphenol A (DMBPA) is a potent HIF-1α inhibitor. Dimethyl-bisphenol A can decrease Vegfa mRNA expression[1].

   

4-[(4-aminophenyl)diazenyl]-2-methoxy-5-methylaniline

4-[(4-aminophenyl)diazenyl]-2-methoxy-5-methylaniline

C14H16N4O (256.1324)


   

POLY(ETHYLENE-CO-METHYL ACRYLATE-CO-GLYCIDYL METHACRYLATE)

POLY(ETHYLENE-CO-METHYL ACRYLATE-CO-GLYCIDYL METHACRYLATE)

C13H20O5 (256.1311)


   

Prilocaine hydrochloride

Prilocaine hydrochloride

C13H21ClN2O (256.1342)


D002491 - Central Nervous System Agents > D002492 - Central Nervous System Depressants > D000777 - Anesthetics D018373 - Peripheral Nervous System Agents > D018689 - Sensory System Agents C78272 - Agent Affecting Nervous System > C245 - Anesthetic Agent

   

2-(2-(PIPERIDIN-1-YL)ETHOXY)ANILINE, HCL

2-(2-(PIPERIDIN-1-YL)ETHOXY)ANILINE, HCL

C13H21ClN2O (256.1342)


   

(3aR,4S,5R,6aS)-Hexahydro-4-(hydroxymethyl)-5-[(tetrahydro-2H-pyran-2-yl)oxy]-2H-cyclopenta[b]furan-2-one

(3aR,4S,5R,6aS)-Hexahydro-4-(hydroxymethyl)-5-[(tetrahydro-2H-pyran-2-yl)oxy]-2H-cyclopenta[b]furan-2-one

C13H20O5 (256.1311)


   

5-Azaspiro[2.3]hexane ethanedioate (2:1)

5-Azaspiro[2.3]hexane ethanedioate (2:1)

C12H20N2O4 (256.1423)


   

2-Boc-7-oxo-8-oxa-2,6-diaza-spiro[4.5]decane

2-Boc-7-oxo-8-oxa-2,6-diaza-spiro[4.5]decane

C12H20N2O4 (256.1423)


   

3-(2-Methoxy-5-methylphenyl)-3-phenyl-1-propanol

3-(2-Methoxy-5-methylphenyl)-3-phenyl-1-propanol

C17H20O2 (256.1463)


   

tert-butyl 2-oxo-1-oxa-3,8-diazaspiro[4.5]decane-8-carboxylate

tert-butyl 2-oxo-1-oxa-3,8-diazaspiro[4.5]decane-8-carboxylate

C12H20N2O4 (256.1423)


   

3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,8-naphthyridine

3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,8-naphthyridine

C14H17BN2O2 (256.1383)


   

1,1-BIS(4-HYDROXYPHENYL)PENTANE

1,1-BIS(4-HYDROXYPHENYL)PENTANE

C17H20O2 (256.1463)


   

acrylonitrile/butadiene copolymer

acrylonitrile/butadiene copolymer

C13H20O5 (256.1311)


   

Tert-butyl (1-(methoxy(methyl)amino)-1-oxopent-4-yn-2-yl)carbamate

Tert-butyl (1-(methoxy(methyl)amino)-1-oxopent-4-yn-2-yl)carbamate

C12H20N2O4 (256.1423)


   

4,4-METHYLENEBIS(2,5-DIMETHYLPHENOL)

4,4-METHYLENEBIS(2,5-DIMETHYLPHENOL)

C17H20O2 (256.1463)


   

SODIUM PROPOXY PPG-2 ACETATE

SODIUM PROPOXY PPG-2 ACETATE

C11H21NaO5 (256.1287)


   

1H-Indazole-5-carboxamide,N-(1R,3R,4S)-1-azabicyclo[2.2.1]hept-3-yl-(9CI)

1H-Indazole-5-carboxamide,N-(1R,3R,4S)-1-azabicyclo[2.2.1]hept-3-yl-(9CI)

C14H16N4O (256.1324)


   

6-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)quinazoline

6-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)quinazoline

C14H17BN2O2 (256.1383)


   

t-BUTYL METHYLPHENOXY PHENOL

t-BUTYL METHYLPHENOXY PHENOL

C17H20O2 (256.1463)


   

1,4-BUTANEDIOL BIS(β-AMINOCROTONATE)

1,4-BUTANEDIOL BIS(β-AMINOCROTONATE)

C12H20N2O4 (256.1423)


   

2-AMINO-5,6,7,8-TETRAHYDRO-6-(PHENYLMETHYL)PYRIDO[4,3-D]PYRIMIDIN-4(3H)-ONE

2-AMINO-5,6,7,8-TETRAHYDRO-6-(PHENYLMETHYL)PYRIDO[4,3-D]PYRIMIDIN-4(3H)-ONE

C14H16N4O (256.1324)


   

1H-Pyrrolo[2,3-c]pyridine-5-carboxamide,N-2-azabicyclo[2.2.1]hept-6-yl-(9CI)

1H-Pyrrolo[2,3-c]pyridine-5-carboxamide,N-2-azabicyclo[2.2.1]hept-6-yl-(9CI)

C14H16N4O (256.1324)


   

1-[1-[(2-methylpropan-2-yl)oxycarbonyl]azetidin-3-yl]azetidine-3-carboxylic acid

1-[1-[(2-methylpropan-2-yl)oxycarbonyl]azetidin-3-yl]azetidine-3-carboxylic acid

C12H20N2O4 (256.1423)


   

4,4-Methylenebis(2,6-dimethylphenol)

4,4-Methylenebis(2,6-dimethylphenol)

C17H20O2 (256.1463)


   

N-(3-(Bis(2-cyanoethyl)amino)phenyl)acetamide

N-(3-(Bis(2-cyanoethyl)amino)phenyl)acetamide

C14H16N4O (256.1324)


   

Silane, (diphenylmethoxy)trimethyl-

Silane, (diphenylmethoxy)trimethyl-

C16H20OSi (256.1283)


   

Benzene, 1,1-[propylidenebis(oxymethylene)]bis-

Benzene, 1,1-[propylidenebis(oxymethylene)]bis-

C17H20O2 (256.1463)


   

1,1-Diphenyl-2-(trimethylsilyl)hydrazine

1,1-Diphenyl-2-(trimethylsilyl)hydrazine

C15H20N2Si (256.1396)


   

5-Pentyl-2-phenoxyphenol

5-Pentyl-2-phenoxyphenol

C17H20O2 (256.1463)


   

(2e)-3-(2-Oct-1-Yn-1-Ylphenyl)acrylic Acid

(2e)-3-(2-Oct-1-Yn-1-Ylphenyl)acrylic Acid

C17H20O2 (256.1463)


   

(2E,4E,6E,8E,10E,12E)-2,6,11-trimethyltetradeca-2,4,6,8,10,12-hexaenedial

(2E,4E,6E,8E,10E,12E)-2,6,11-trimethyltetradeca-2,4,6,8,10,12-hexaenedial

C17H20O2 (256.1463)


   

L-N-(3-methylhex-2-enoyl)-glutamine

L-N-(3-methylhex-2-enoyl)-glutamine

C12H20N2O4 (256.1423)


   

(2E,4E,6E,8E,10E,12E)-2,7,11-Trimethyl-2,4,6,8,10,12-tetradecahexenedial

(2E,4E,6E,8E,10E,12E)-2,7,11-Trimethyl-2,4,6,8,10,12-tetradecahexenedial

C17H20O2 (256.1463)


   

N,N-dimethyl-1-[3-(1-methyl-3-indolyl)-1,2,4-oxadiazol-5-yl]methanamine

N,N-dimethyl-1-[3-(1-methyl-3-indolyl)-1,2,4-oxadiazol-5-yl]methanamine

C14H16N4O (256.1324)


   

(3,5-Dimethyl-[1,2,4]triazol-4-yl)-[3-(2-methoxy-phenyl)-allylidene]-amine

(3,5-Dimethyl-[1,2,4]triazol-4-yl)-[3-(2-methoxy-phenyl)-allylidene]-amine

C14H16N4O (256.1324)


   

2-[(2-methylphenyl)amino]-N-(1H-pyrrol-2-ylmethylene)acetohydrazide

2-[(2-methylphenyl)amino]-N-(1H-pyrrol-2-ylmethylene)acetohydrazide

C14H16N4O (256.1324)


   

5-amino-4-(1H-benzimidazol-2-yl)-1-propan-2-yl-2H-pyrrol-3-one

5-amino-4-(1H-benzimidazol-2-yl)-1-propan-2-yl-2H-pyrrol-3-one

C14H16N4O (256.1324)


   

2-Allyl-6-{[(E)-3,5-dimethyl-[1,2,4]triazol-4-ylimino]-methyl}-phenol

2-Allyl-6-{[(E)-3,5-dimethyl-[1,2,4]triazol-4-ylimino]-methyl}-phenol

C14H16N4O (256.1324)


   

N-{1-[(2-methylphenyl)amino]-1-oxopropan-2-yl}propan-1-aminium chloride

N-{1-[(2-methylphenyl)amino]-1-oxopropan-2-yl}propan-1-aminium chloride

C13H21ClN2O (256.1342)


   

(1R)-7,8-dihydroxy-1-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepin-3-ium

(1R)-7,8-dihydroxy-1-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepin-3-ium

C16H18NO2+ (256.1337)


   

(1S)-7,8-dihydroxy-1-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepin-3-ium

(1S)-7,8-dihydroxy-1-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepin-3-ium

C16H18NO2+ (256.1337)


   

1,2-Diphenylhydrazine, N-trimethylsilyl-

1,2-Diphenylhydrazine, N-trimethylsilyl-

C15H20N2Si (256.1396)


   

Dimethyl 2,5-dimethylperhydropyrrolo(3,4-C)pyrrole-3A,6A-dicarboxylate

Dimethyl 2,5-dimethylperhydropyrrolo(3,4-C)pyrrole-3A,6A-dicarboxylate

C12H20N2O4 (256.1423)


   

Decarbamoylsaxitoxin

Decarbamoylsaxitoxin

C9H16N6O3 (256.1284)


A pyrrolopurine that is 2,6-diiminodecahydropyrrolo[1,2-c]purine carrying an additional hydroxymethyl substituent at position 4 as well as two hydroxy substituents at position 10. A toxin that is isolated from marine dinoflagellates and cyanobacteria and is known to cause paralytic shellfish poisoning. D009676 - Noxae > D011042 - Poisons > D008978 - Mollusk Venoms D009676 - Noxae > D011042 - Poisons > D008387 - Marine Toxins D009676 - Noxae > D011042 - Poisons > D014688 - Venoms

   

2-[4-(3-Hydroxypropyl)-2-methoxyphenoxy]-1,3-propanediol

2-[4-(3-Hydroxypropyl)-2-methoxyphenoxy]-1,3-propanediol

C13H20O5 (256.1311)


   

(4r,6s,12r)-4-hydroxy-6-methoxy-12-methyl-1-oxacyclododec-9-ene-2,8-dione

(4r,6s,12r)-4-hydroxy-6-methoxy-12-methyl-1-oxacyclododec-9-ene-2,8-dione

C13H20O5 (256.1311)


   

pentadeca-5,7,13-trien-9,11-diyn-1-yl acetate

pentadeca-5,7,13-trien-9,11-diyn-1-yl acetate

C17H20O2 (256.1463)


   

6-[(1r,2r)-1,2-dihydroxyheptyl]-4-methoxypyran-2-one

6-[(1r,2r)-1,2-dihydroxyheptyl]-4-methoxypyran-2-one

C13H20O5 (256.1311)


   

n,n,9-trimethyl-12-(methylimino)-3,5,11,13-tetraazatricyclo[8.3.0.0²,⁶]trideca-1,3,5,7,9-pentaen-4-amine

n,n,9-trimethyl-12-(methylimino)-3,5,11,13-tetraazatricyclo[8.3.0.0²,⁶]trideca-1,3,5,7,9-pentaen-4-amine

C13H16N6 (256.1436)


   

4-hydroxy-6-methoxy-12-methyl-1-oxacyclododec-9-ene-2,8-dione

4-hydroxy-6-methoxy-12-methyl-1-oxacyclododec-9-ene-2,8-dione

C13H20O5 (256.1311)


   

(1s,2s)-1-methoxy-1-(2,4,5-trimethoxyphenyl)propan-2-ol

(1s,2s)-1-methoxy-1-(2,4,5-trimethoxyphenyl)propan-2-ol

C13H20O5 (256.1311)


   

2,8,10-heptadecatriene-4,6-diyne-1,14-diol; (2z,8e,10e,14ξ)-form,14-ketone

NA

C17H20O2 (256.1463)


{"Ingredient_id": "HBIN005043","Ingredient_name": "2,8,10-heptadecatriene-4,6-diyne-1,14-diol; (2z,8e,10e,14\u03be)-form,14-ketone","Alias": "NA","Ingredient_formula": "C17H20O2","Ingredient_Smile": "NA","Ingredient_weight": "256.34","OB_score": "NA","CAS_id": "111128-28-0","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "8802","PubChem_id": "NA","DrugBank_id": "NA"}

   

benzoicacid,4-isopropenylcyclo-hexenylmethylester

NA

C17H20O2 (256.1463)


{"Ingredient_id": "HBIN017793","Ingredient_name": "benzoicacid,4-isopropenylcyclo-hexenylmethylester","Alias": "NA","Ingredient_formula": "C17H20O2","Ingredient_Smile": "CC(=C)C1CCC(=CC1)COC(=O)C2=CC=CC=C2","Ingredient_weight": "256.34 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "43041","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "570805","DrugBank_id": "NA"}

   

2-(7-oxooctyl)pent-2-enedioic acid

2-(7-oxooctyl)pent-2-enedioic acid

C13H20O5 (256.1311)


   

2-(7-hydroxyoctylidene)-3-methylidenebutanedioic acid

2-(7-hydroxyoctylidene)-3-methylidenebutanedioic acid

C13H20O5 (256.1311)


   

6-(1,6-dihydroxyheptyl)-4-methoxypyran-2-one

6-(1,6-dihydroxyheptyl)-4-methoxypyran-2-one

C13H20O5 (256.1311)


   

(5e,7e,13e)-pentadeca-5,7,13-trien-9,11-diyn-1-yl acetate

(5e,7e,13e)-pentadeca-5,7,13-trien-9,11-diyn-1-yl acetate

C17H20O2 (256.1463)


   

(2r,4s)-6-(3-hydroxy-4-methoxyphenyl)hexane-1,2,4-triol

(2r,4s)-6-(3-hydroxy-4-methoxyphenyl)hexane-1,2,4-triol

C13H20O5 (256.1311)


   

12-imino-n,n,9,13-tetramethyl-3,5,11,13-tetraazatricyclo[8.3.0.0²,⁶]trideca-1,3,5,7,9-pentaen-4-amine

12-imino-n,n,9,13-tetramethyl-3,5,11,13-tetraazatricyclo[8.3.0.0²,⁶]trideca-1,3,5,7,9-pentaen-4-amine

C13H16N6 (256.1436)


   

(5s)-2-imino-5-(1h-indol-3-ylmethyl)-1,3-dimethylimidazolidin-4-one

(5s)-2-imino-5-(1h-indol-3-ylmethyl)-1,3-dimethylimidazolidin-4-one

C14H16N4O (256.1324)


   

(3r)-3-methoxy-3-(3,4,5-trimethoxyphenyl)propan-1-ol

(3r)-3-methoxy-3-(3,4,5-trimethoxyphenyl)propan-1-ol

C13H20O5 (256.1311)


   

(7e,9e)-17-hydroxyheptadeca-7,9,15-trien-11,13-diyn-4-one

(7e,9e)-17-hydroxyheptadeca-7,9,15-trien-11,13-diyn-4-one

C17H20O2 (256.1463)


   

6-[(1r,2s)-1,2-dihydroxyheptyl]-4-methoxypyran-2-one

6-[(1r,2s)-1,2-dihydroxyheptyl]-4-methoxypyran-2-one

C13H20O5 (256.1311)


   

3-methoxy-3-(3,4,5-trimethoxyphenyl)propan-1-ol

3-methoxy-3-(3,4,5-trimethoxyphenyl)propan-1-ol

C13H20O5 (256.1311)


   

(1s,3s,5r,8s)-3,8-dihydroxy-8-[(1e,3r)-3-hydroxybut-1-en-1-yl]-1,5-dimethyl-6-oxabicyclo[3.2.1]octan-7-one

(1s,3s,5r,8s)-3,8-dihydroxy-8-[(1e,3r)-3-hydroxybut-1-en-1-yl]-1,5-dimethyl-6-oxabicyclo[3.2.1]octan-7-one

C13H20O5 (256.1311)


   

2-[6-methyl-6-(4-oxopent-2-en-1-yl)-1,2-dioxan-3-yl]propanoic acid

2-[6-methyl-6-(4-oxopent-2-en-1-yl)-1,2-dioxan-3-yl]propanoic acid

C13H20O5 (256.1311)


   

(9z)-heptadeca-1,9-dien-4,6-diyne-3,8-dione

(9z)-heptadeca-1,9-dien-4,6-diyne-3,8-dione

C17H20O2 (256.1463)


   

(2r,3s,4r,4as,7r,8as)-3,4-dihydroxy-2,7-dimethyl-2-[(1e)-prop-1-en-1-yl]-hexahydropyrano[3,2-c]pyran-5-one

(2r,3s,4r,4as,7r,8as)-3,4-dihydroxy-2,7-dimethyl-2-[(1e)-prop-1-en-1-yl]-hexahydropyrano[3,2-c]pyran-5-one

C13H20O5 (256.1311)


   

(6s)-4,6,9-trimethyl-5,6,7,8-tetrahydrophenanthrene-1,2-diol

(6s)-4,6,9-trimethyl-5,6,7,8-tetrahydrophenanthrene-1,2-diol

C17H20O2 (256.1463)


   

1,5-diphenylpentane-1,3-diol

1,5-diphenylpentane-1,3-diol

C17H20O2 (256.1463)


   

(1r,2s)-2-{[(2r,2'r,3r,3's)-3'-[(1r)-1-hydroxybutyl]-[2,2'-bioxiran]-3-yl]methyl}cyclopropyl formate

(1r,2s)-2-{[(2r,2'r,3r,3's)-3'-[(1r)-1-hydroxybutyl]-[2,2'-bioxiran]-3-yl]methyl}cyclopropyl formate

C13H20O5 (256.1311)


   

(2e)-2-[(6s)-6-hydroxyoctylidene]-3-methylidenebutanedioic acid

(2e)-2-[(6s)-6-hydroxyoctylidene]-3-methylidenebutanedioic acid

C13H20O5 (256.1311)


   

(7e,9e,15e)-17-hydroxyheptadeca-7,9,15-trien-11,13-diyn-4-one

(7e,9e,15e)-17-hydroxyheptadeca-7,9,15-trien-11,13-diyn-4-one

C17H20O2 (256.1463)


   

n,n,9-trimethyl-12-(methylimino)-3,5,11,13-tetraazatricyclo[8.3.0.0²,⁶]trideca-1(13),2(6),4,7,9-pentaen-4-amine

n,n,9-trimethyl-12-(methylimino)-3,5,11,13-tetraazatricyclo[8.3.0.0²,⁶]trideca-1(13),2(6),4,7,9-pentaen-4-amine

C13H16N6 (256.1436)


   

heptadeca-1,9-dien-4,6-diyne-3,8-dione

heptadeca-1,9-dien-4,6-diyne-3,8-dione

C17H20O2 (256.1463)


   

(7e,9e,15z)-17-hydroxyheptadeca-7,9,15-trien-11,13-diyn-4-one

(7e,9e,15z)-17-hydroxyheptadeca-7,9,15-trien-11,13-diyn-4-one

C17H20O2 (256.1463)


   

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

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

C12H20N2O4 (256.1423)


   

12-imino-n,n,2,13-tetramethyl-4,6,11,13-tetraazatricyclo[8.3.0.0³,⁷]trideca-1,3,5,7,9-pentaen-5-amine

12-imino-n,n,2,13-tetramethyl-4,6,11,13-tetraazatricyclo[8.3.0.0³,⁷]trideca-1,3,5,7,9-pentaen-5-amine

C13H16N6 (256.1436)


   

(3s,8e,11r,12e,14z)-heptadeca-1,8,12,14-tetraen-4,6-diyne-3,11-diol

(3s,8e,11r,12e,14z)-heptadeca-1,8,12,14-tetraen-4,6-diyne-3,11-diol

C17H20O2 (256.1463)


   

(4s,10r,12r)-4-hydroxy-10-methoxy-12-methyl-1-oxacyclododec-5-ene-2,8-dione

(4s,10r,12r)-4-hydroxy-10-methoxy-12-methyl-1-oxacyclododec-5-ene-2,8-dione

C13H20O5 (256.1311)


   

methyl hexadeca-6,8,14-trien-10,12-diynoate

methyl hexadeca-6,8,14-trien-10,12-diynoate

C17H20O2 (256.1463)


   

(1s,3s)-1,5-diphenylpentane-1,3-diol

(1s,3s)-1,5-diphenylpentane-1,3-diol

C17H20O2 (256.1463)


   

(1r,2r)-2-methoxy-1-(2,4,5-trimethoxyphenyl)propan-1-ol

(1r,2r)-2-methoxy-1-(2,4,5-trimethoxyphenyl)propan-1-ol

C13H20O5 (256.1311)


   

methyl (6e,8e,14e)-hexadeca-6,8,14-trien-10,12-diynoate

methyl (6e,8e,14e)-hexadeca-6,8,14-trien-10,12-diynoate

C17H20O2 (256.1463)


   

3,4-dihydroxy-2,7-dimethyl-2-(prop-1-en-1-yl)-hexahydropyrano[3,2-c]pyran-5-one

3,4-dihydroxy-2,7-dimethyl-2-(prop-1-en-1-yl)-hexahydropyrano[3,2-c]pyran-5-one

C13H20O5 (256.1311)


   

6-(1,2-dihydroxyheptyl)-4-methoxypyran-2-one

6-(1,2-dihydroxyheptyl)-4-methoxypyran-2-one

C13H20O5 (256.1311)


   

2-(1-hydroxy-2-methylpropyl)-3,4,5-trimethoxyphenol

2-(1-hydroxy-2-methylpropyl)-3,4,5-trimethoxyphenol

C13H20O5 (256.1311)


   

4,5-dimethoxy-6-(1-methoxy-2-methylpropyl)benzene-1,3-diol

4,5-dimethoxy-6-(1-methoxy-2-methylpropyl)benzene-1,3-diol

C13H20O5 (256.1311)


   

(3as,4r)-4-(hydroxymethyl)-2,6-diimino-hexahydro-1h-pyrrolo[1,2-c]purine-10,10-diol

(3as,4r)-4-(hydroxymethyl)-2,6-diimino-hexahydro-1h-pyrrolo[1,2-c]purine-10,10-diol

C9H16N6O3 (256.1284)


   

2-[(1s)-1-hydroxy-2-methylpropyl]-3,4,5-trimethoxyphenol

2-[(1s)-1-hydroxy-2-methylpropyl]-3,4,5-trimethoxyphenol

C13H20O5 (256.1311)


   

(12e)-heptadeca-1,8,12,14-tetraen-4,6-diyne-3,11-diol

(12e)-heptadeca-1,8,12,14-tetraen-4,6-diyne-3,11-diol

C17H20O2 (256.1463)


   

2-(8-hydroxyoctylidene)-3-methylidenebutanedioic acid

2-(8-hydroxyoctylidene)-3-methylidenebutanedioic acid

C13H20O5 (256.1311)


   

(3as,4r,10as)-4-(hydroxymethyl)-2,6-diimino-hexahydro-1h-pyrrolo[1,2-c]purine-10,10-diol

(3as,4r,10as)-4-(hydroxymethyl)-2,6-diimino-hexahydro-1h-pyrrolo[1,2-c]purine-10,10-diol

C9H16N6O3 (256.1284)


   

(2r)-2-[(3r,6s)-6-methyl-6-[(2e)-4-oxopent-2-en-1-yl]-1,2-dioxan-3-yl]propanoic acid

(2r)-2-[(3r,6s)-6-methyl-6-[(2e)-4-oxopent-2-en-1-yl]-1,2-dioxan-3-yl]propanoic acid

C13H20O5 (256.1311)


   

17-hydroxyheptadeca-5,7,9-trien-11,13-diyn-4-one

17-hydroxyheptadeca-5,7,9-trien-11,13-diyn-4-one

C17H20O2 (256.1463)


   

3,8-dihydroxy-8-(3-hydroxybut-1-en-1-yl)-1,5-dimethyl-6-oxabicyclo[3.2.1]octan-7-one

3,8-dihydroxy-8-(3-hydroxybut-1-en-1-yl)-1,5-dimethyl-6-oxabicyclo[3.2.1]octan-7-one

C13H20O5 (256.1311)


   

(4s,5e,10s,12r)-4-hydroxy-10-methoxy-12-methyl-1-oxacyclododec-5-ene-2,8-dione

(4s,5e,10s,12r)-4-hydroxy-10-methoxy-12-methyl-1-oxacyclododec-5-ene-2,8-dione

C13H20O5 (256.1311)


   

(2e)-2-(7-hydroxyoctylidene)-3-methylidenebutanedioic acid

(2e)-2-(7-hydroxyoctylidene)-3-methylidenebutanedioic acid

C13H20O5 (256.1311)


   

2-(1-hydroxyheptyl)-4-methyl-5-oxo-2h-furan-3-carboxylic acid

2-(1-hydroxyheptyl)-4-methyl-5-oxo-2h-furan-3-carboxylic acid

C13H20O5 (256.1311)


   

methyl (6e,8e,14z)-hexadeca-6,8,14-trien-10,12-diynoate

methyl (6e,8e,14z)-hexadeca-6,8,14-trien-10,12-diynoate

C17H20O2 (256.1463)


   

(2r)-2-(1-hydroxyheptyl)-4-methyl-5-oxo-2h-furan-3-carboxylic acid

(2r)-2-(1-hydroxyheptyl)-4-methyl-5-oxo-2h-furan-3-carboxylic acid

C13H20O5 (256.1311)


   

(2z)-2-(7-oxooctyl)pent-2-enedioic acid

(2z)-2-(7-oxooctyl)pent-2-enedioic acid

C13H20O5 (256.1311)


   

17-hydroxyheptadeca-7,9,15-trien-11,13-diyn-4-one

17-hydroxyheptadeca-7,9,15-trien-11,13-diyn-4-one

C17H20O2 (256.1463)


   

(2r,3s,4s,4as,7r,8as)-3,4-dihydroxy-2,7-dimethyl-2-[(1e)-prop-1-en-1-yl]-hexahydropyrano[3,2-c]pyran-5-one

(2r,3s,4s,4as,7r,8as)-3,4-dihydroxy-2,7-dimethyl-2-[(1e)-prop-1-en-1-yl]-hexahydropyrano[3,2-c]pyran-5-one

C13H20O5 (256.1311)


   

4-hydroxy-10-methoxy-12-methyl-1-oxacyclododec-5-ene-2,8-dione

4-hydroxy-10-methoxy-12-methyl-1-oxacyclododec-5-ene-2,8-dione

C13H20O5 (256.1311)


   

4,6,9-trimethyl-5,6,7,8-tetrahydrophenanthrene-1,2-diol

4,6,9-trimethyl-5,6,7,8-tetrahydrophenanthrene-1,2-diol

C17H20O2 (256.1463)


   

(2e)-2-(8-hydroxyoctylidene)-3-methylidenebutanedioic acid

(2e)-2-(8-hydroxyoctylidene)-3-methylidenebutanedioic acid

C13H20O5 (256.1311)


   

4,5-dimethoxy-6-[(1r)-1-methoxy-2-methylpropyl]benzene-1,3-diol

4,5-dimethoxy-6-[(1r)-1-methoxy-2-methylpropyl]benzene-1,3-diol

C13H20O5 (256.1311)


   

(5e,7e,9e)-17-hydroxyheptadeca-5,7,9-trien-11,13-diyn-4-one

(5e,7e,9e)-17-hydroxyheptadeca-5,7,9-trien-11,13-diyn-4-one

C17H20O2 (256.1463)


   

12-imino-n,n,9,11-tetramethyl-3,5,11,13-tetraazatricyclo[8.3.0.0²,⁶]trideca-1,3,5,7,9-pentaen-7-amine

12-imino-n,n,9,11-tetramethyl-3,5,11,13-tetraazatricyclo[8.3.0.0²,⁶]trideca-1,3,5,7,9-pentaen-7-amine

C13H16N6 (256.1436)


   

2-methoxy-1-(2,4,5-trimethoxyphenyl)propan-1-ol

2-methoxy-1-(2,4,5-trimethoxyphenyl)propan-1-ol

C13H20O5 (256.1311)


   

2,4-dihydroxy-3,6-bis(2-methylpropyl)-5-oxopyrazin-1-ium-1-olate

2,4-dihydroxy-3,6-bis(2-methylpropyl)-5-oxopyrazin-1-ium-1-olate

C12H20N2O4 (256.1423)


   

2-(6-hydroxyoctylidene)-3-methylidenebutanedioic acid

2-(6-hydroxyoctylidene)-3-methylidenebutanedioic acid

C13H20O5 (256.1311)