Exact Mass: 256.1495

Exact Mass Matches: 256.1495

Found 149 metabolites which its exact mass value is equals to given mass value 256.1495, within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error 0.001 dalton.

Huperzine

1H-5,10b-Propeno-1,7-phenanthrolin-8(7H)-one, 2,3,4,4a,5,6-hexahydro-12-methyl-, [4aR-(4aalpha,5alpha,10balpha)]-

C16H20N2O (256.1576)


Huperzine b is a phenanthrol. Huperzine B is a novel acetylcholinesterase inhibitor. Huperzine b is a natural product found in Huperzia quasipolytrichoides, Huperzia herteriana, and other organisms with data available. Huperzine B is a Lycopodium alkaloid isolated from Huperzia serrata and a highly selective acetylcholinesterase (AChE) inhibitor. Huperzine B can be uesd to can be used to improve Alzheimer's disease[1][2]. Huperzine B is a Lycopodium alkaloid isolated from Huperzia serrata and a highly selective acetylcholinesterase (AChE) inhibitor. Huperzine B can be uesd to can be used to improve Alzheimer's disease[1][2].

   

Chanoclavine

2-Propen-1-ol, 2-methyl-3-(1,3,4,5-tetrahydro-4-(methylamino)benz(cd)indol-5-yl)-, (4R-(4alpha,5beta(E)))-

C16H20N2O (256.1576)


CONFIDENCE Claviceps purpurea sclerotia

   

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)


   

(-)-Fumigaclavine B

4,6-dimethyl-6,11-diazatetracyclo[7.6.1.0²,⁷.0¹²,¹⁶]hexadeca-1(16),9,12,14-tetraen-3-ol

C16H20N2O (256.1576)


(-)-Fumigaclavine B is a mycotoxin from Aspergillus fumigatus and Rhizopus arrhizu

   

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).

   

dihydrochanoclavine-I aldehyde

dihydrochanoclavine-I aldehyde

C16H20N2O (256.1576)


An ergot alkaloid that is 1,3,4,5-tetrahydrobenzo[cd]indole which is substituted at position 4 by a methylamino group and at position 5 by a 2-methyl-3-oxopropyl group (the 4R,5R diastereoisomer).

   

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)


   

Leucine-beta-naphthylamide

2-amino-4-methyl-N-(naphthalen-2-yl)pentanamide

C16H20N2O (256.1576)


   

huperzine b

16-methyl-6,14-diazatetracyclo[7.5.3.0¹,¹⁰.0²,⁷]heptadeca-2(7),3,16-trien-5-one

C16H20N2O (256.1576)


   

N-Demethylhuperzinine

N-Demethylhuperzinine

C16H20N2O (256.1576)


   
   

Pheniramine N-Oxide

Pheniramine N-Oxide

C16H20N2O (256.1576)


   

CHEMBL490375

CHEMBL490375

C17H20O2 (256.1463)


   

2-Methyl-1-(4-methylamino-1,3,4,5-tetrahydrobenzo[cd]indol-5-yl)-prop-2-en-1-ol

2-Methyl-1-(4-methylamino-1,3,4,5-tetrahydrobenzo[cd]indol-5-yl)-prop-2-en-1-ol

C16H20N2O (256.1576)


   

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)


   

(+-)-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)


   

Palyzoanthoxanthin A

Palyzoanthoxanthin A

C13H16N6 (256.1436)


   

Oprea1_579880

Oprea1_579880

C16H20N2O (256.1576)


   

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)


   

N-acetylkomaroidine

N-acetylkomaroidine

C16H20N2O (256.1576)


   

Paragracine

Paragracine

C13H16N6 (256.1436)


   

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)


   

6,8-dimethyl-ergolin-8-ol|9,10-dihydro-setoclavine|Dihydro-setoclavin-I|Dihydrosetoclavine

6,8-dimethyl-ergolin-8-ol|9,10-dihydro-setoclavine|Dihydro-setoclavin-I|Dihydrosetoclavine

C16H20N2O (256.1576)


   

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)


   

SCHEMBL12555516

SCHEMBL12555516

C12H20N2O4 (256.1423)


   

Galanthamine

Galanthamine

C17H20O2 (256.1463)


   

SCHEMBL16661546

SCHEMBL16661546

C17H20O2 (256.1463)


   

Bis(4-ethoxyphenyl)methane

Bis(4-ethoxyphenyl)methane

C17H20O2 (256.1463)


   

6,9-Dimethyl-7-hydroxyergolin|6,9-dimethyl-ergolin-7-ol

6,9-Dimethyl-7-hydroxyergolin|6,9-dimethyl-ergolin-7-ol

C16H20N2O (256.1576)


   

(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)


   

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)


   

Stilbostemin M

Stilbostemin M

C17H20O2 (256.1463)


   

(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)


   

Pheniramine-N-oxide

N,N-dimethyl-3-phenyl-3-pyridin-2-ylpropan-1-amine oxide

C16H20N2O (256.1576)


CONFIDENCE standard compound; EAWAG_UCHEM_ID 3254 CONFIDENCE standard compound; INTERNAL_ID 2076

   

PHE_257.1648_10.4

PHE_257.1648_10.4

C16H20N2O (256.1576)


CONFIDENCE Transformation product with Reference Standard (Level 1); INTERNAL_ID 1502

   

alpha-Dihydrolysergol

alpha-Dihydrolysergol

C16H20N2O (256.1576)


SubCategory_DNP: : Alkaloids derived from tryptophan, Ergot alkaloids, Clavine alkaloid

   

(E)-2-methyl-4-((3aS)-1-methyl-2,3,8,8a-tetrahydropyrrolo[2,3-b]indol-3a(1H)-yl)but-2-enal

(E)-2-methyl-4-((3aS)-1-methyl-2,3,8,8a-tetrahydropyrrolo[2,3-b]indol-3a(1H)-yl)but-2-enal

C16H20N2O (256.1576)


   

fumigaclavine B

4,6-dimethyl-6,11-diazatetracyclo[7.6.1.0^{2,7}.0^{12,16}]hexadeca-1(16),9,12,14-tetraen-3-ol

C16H20N2O (256.1576)


An ergot alkaloid produced by the fungus Aspergillus fumigatus that consists of ergoline substituted by two methyl groups at the 6 and 8beta positions, and by a hydroxy group at the 9beta position.

   

Falcarindione

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

C17H20O2 (256.1463)


   

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)


   

1-(4-tert-butylphenyl)-2-pyrimidin-4-ylethanol

1-(4-tert-butylphenyl)-2-pyrimidin-4-ylethanol

C16H20N2O (256.1576)


   

2,2-Dibenzyl-1,3-propanediol

2,2-Dibenzyl-1,3-propanediol

C17H20O2 (256.1463)


   

5-(bicycloheptenyl)triethoxysilane

5-(bicycloheptenyl)triethoxysilane

C13H24O3Si (256.1495)


   

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

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

C17H20O2 (256.1463)


   

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)


   

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].

   

N-[4-(DIMETHYLAMINO)BENZYL]-N-(4-METHOXYPHENYL)AMINE

N-[4-(DIMETHYLAMINO)BENZYL]-N-(4-METHOXYPHENYL)AMINE

C16H20N2O (256.1576)


   

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)


   

1,1-bis(diethylamino)tetrafluoro-1-propene

1,1-bis(diethylamino)tetrafluoro-1-propene

C11H20F4N2 (256.1563)


   

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)


   

1,1-BIS(4-HYDROXYPHENYL)PENTANE

1,1-BIS(4-HYDROXYPHENYL)PENTANE

C17H20O2 (256.1463)


   

NCI-83633

Leucine-beta-naphthylamide

C16H20N2O (256.1576)


   

2-methyl-4-(piperidin-4-yloxymethyl)quinoline

2-methyl-4-(piperidin-4-yloxymethyl)quinoline

C16H20N2O (256.1576)


   

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)


   

(alphaR)-alpha-[[[2-(4-Aminophenyl)ethyl]amino]methyl]-benzenemethanol

(alphaR)-alpha-[[[2-(4-Aminophenyl)ethyl]amino]methyl]-benzenemethanol

C16H20N2O (256.1576)


   

4-(4-AMino-3,5-diMethylphenoxy)-2,6-diMethylaniline

4-(4-AMino-3,5-diMethylphenoxy)-2,6-diMethylaniline

C16H20N2O (256.1576)


   

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)


   

3-Dimethylaminomethyl-1,2,3,4-tetrahydro-9-methylcarbazol-4-one

3-Dimethylaminomethyl-1,2,3,4-tetrahydro-9-methylcarbazol-4-one

C16H20N2O (256.1576)


   

3-[(Dimethylamino)methyl]-9-methyl-1,2,3,9-tetrahydro-4H-carbazol-4-one

3-[(Dimethylamino)methyl]-9-methyl-1,2,3,9-tetrahydro-4H-carbazol-4-one

C16H20N2O (256.1576)


   

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)


   

1-[(6-aminonaphthalen-2-yl)methyl]piperidin-4-ol

1-[(6-aminonaphthalen-2-yl)methyl]piperidin-4-ol

C16H20N2O (256.1576)


   

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

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

C17H20O2 (256.1463)


   

Pentanamide, 2-amino-4-methyl-N-2-naphthalenyl-

Pentanamide, 2-amino-4-methyl-N-2-naphthalenyl-

C16H20N2O (256.1576)


   

L-Isoleucine beta-naphthylamide

L-Isoleucine beta-naphthylamide

C16H20N2O (256.1576)


   

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)


   

(8beta,9beta)-6,8-Dimethylergolin-9-ol

(8beta,9beta)-6,8-Dimethylergolin-9-ol

C16H20N2O (256.1576)


   

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)


   

1-(2,6-dimethyl-1H-indol-3-yl)-2-(1-pyrrolidinyl)ethanone

1-(2,6-dimethyl-1H-indol-3-yl)-2-(1-pyrrolidinyl)ethanone

C16H20N2O (256.1576)


   

1,2-Diphenylhydrazine, N-trimethylsilyl-

1,2-Diphenylhydrazine, N-trimethylsilyl-

C15H20N2Si (256.1396)


   

[3-carboxy-2-[(2E,4E)-hexa-2,4-dienoyl]oxypropyl]-trimethylazanium

[3-carboxy-2-[(2E,4E)-hexa-2,4-dienoyl]oxypropyl]-trimethylazanium

C13H22NO4+ (256.1549)


   

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)


   

N,N-dimethyl-3-phenyl-3-pyridin-2-ylpropan-1-amine oxide

N,N-dimethyl-3-phenyl-3-pyridin-2-ylpropan-1-amine oxide

C16H20N2O (256.1576)


   

Chanoclavine-I

Chanoclavine-I

C16H20N2O (256.1576)


An organic tricyclic compound that is 1,3,4,5-tetrahydrobenzo[cd]indole which is substituted at position 4 by a methylamino group and at position 5 by a 3-hydroxy-2-methylprop-1-en-1-yl group (the 4R,5R,E diastereoisomer). It is a precursor of the tetracyclic ergolines agroclavine, elymoclavine and lysergic acid amide.

   
   

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)


   

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)


   

(1r,9r,13s)-13-ethenyl-11-methyl-1-(methylamino)-6-azatricyclo[7.3.1.0²,⁷]trideca-2,4,6,10-tetraen-5-ol

(1r,9r,13s)-13-ethenyl-11-methyl-1-(methylamino)-6-azatricyclo[7.3.1.0²,⁷]trideca-2,4,6,10-tetraen-5-ol

C16H20N2O (256.1576)


   

(6z)-3-methyl-6-(3-methylbut-2-en-1-ylidene)-4,5-dihydro-1,3-benzodiazocin-7-ol

(6z)-3-methyl-6-(3-methylbut-2-en-1-ylidene)-4,5-dihydro-1,3-benzodiazocin-7-ol

C16H20N2O (256.1576)


   

(9s,10r)-16-methyl-6,14-diazatetracyclo[7.5.3.0¹,¹⁰.0²,⁷]heptadeca-2,4,6,16-tetraen-5-ol

(9s,10r)-16-methyl-6,14-diazatetracyclo[7.5.3.0¹,¹⁰.0²,⁷]heptadeca-2,4,6,16-tetraen-5-ol

C16H20N2O (256.1576)


   

(1s,9s,10s)-16-methyl-6,14-diazatetracyclo[7.5.3.0¹,¹⁰.0²,⁷]heptadeca-2,4,6,16-tetraen-5-ol

(1s,9s,10s)-16-methyl-6,14-diazatetracyclo[7.5.3.0¹,¹⁰.0²,⁷]heptadeca-2,4,6,16-tetraen-5-ol

C16H20N2O (256.1576)


   

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"}

   

(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)


   

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)


   

(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)


   

chanoclavine ii

chanoclavine ii

C16H20N2O (256.1576)


   

(2e)-2-methyl-3-[(6s,7s)-6-(methylamino)-2-azatricyclo[6.3.1.0⁴,¹²]dodeca-1(11),3,8(12),9-tetraen-7-yl]prop-2-en-1-ol

(2e)-2-methyl-3-[(6s,7s)-6-(methylamino)-2-azatricyclo[6.3.1.0⁴,¹²]dodeca-1(11),3,8(12),9-tetraen-7-yl]prop-2-en-1-ol

C16H20N2O (256.1576)


   

2-methyl-1-[6-(methylamino)-2-azatricyclo[6.3.1.0⁴,¹²]dodeca-1(11),3,8(12),9-tetraen-7-yl]prop-2-en-1-ol

2-methyl-1-[6-(methylamino)-2-azatricyclo[6.3.1.0⁴,¹²]dodeca-1(11),3,8(12),9-tetraen-7-yl]prop-2-en-1-ol

C16H20N2O (256.1576)


   

(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,4s,7r)-4,6-dimethyl-6,11-diazatetracyclo[7.6.1.0²,⁷.0¹²,¹⁶]hexadeca-1(16),9,12,14-tetraen-4-ol

(2r,4s,7r)-4,6-dimethyl-6,11-diazatetracyclo[7.6.1.0²,⁷.0¹²,¹⁶]hexadeca-1(16),9,12,14-tetraen-4-ol

C16H20N2O (256.1576)


   

(2r,9s,11r,12r,14r,16s)-14-methyl-1,4-diazapentacyclo[7.7.1.0²,¹².0³,⁸.0¹¹,¹⁶]heptadeca-3,5,7-trien-5-ol

(2r,9s,11r,12r,14r,16s)-14-methyl-1,4-diazapentacyclo[7.7.1.0²,¹².0³,⁸.0¹¹,¹⁶]heptadeca-3,5,7-trien-5-ol

C16H20N2O (256.1576)


   

(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)


   

(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)


   

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

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

C16H20N2O (256.1576)


   

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)


   

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

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

C17H20O2 (256.1463)


   

(2z)-2-methyl-3-[(6r,7r)-6-(methylamino)-2-azatricyclo[6.3.1.0⁴,¹²]dodeca-1(11),3,8(12),9-tetraen-7-yl]prop-2-en-1-ol

(2z)-2-methyl-3-[(6r,7r)-6-(methylamino)-2-azatricyclo[6.3.1.0⁴,¹²]dodeca-1(11),3,8(12),9-tetraen-7-yl]prop-2-en-1-ol

C16H20N2O (256.1576)


   

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

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

C17H20O2 (256.1463)


   

(1r,9s,10r)-16-methyl-6,14-diazatetracyclo[7.5.3.0¹,¹⁰.0²,⁷]heptadeca-2,4,6,16-tetraen-5-ol

(1r,9s,10r)-16-methyl-6,14-diazatetracyclo[7.5.3.0¹,¹⁰.0²,⁷]heptadeca-2,4,6,16-tetraen-5-ol

C16H20N2O (256.1576)


   

(1r,9r,13r)-13-ethenyl-11-methyl-1-(methylamino)-6-azatricyclo[7.3.1.0²,⁷]trideca-2,4,6,10-tetraen-5-ol

(1r,9r,13r)-13-ethenyl-11-methyl-1-(methylamino)-6-azatricyclo[7.3.1.0²,⁷]trideca-2,4,6,10-tetraen-5-ol

C16H20N2O (256.1576)


   

1-[(1r)-1-propyl-1h,3h,4h,9h-pyrido[3,4-b]indol-2-yl]ethanone

1-[(1r)-1-propyl-1h,3h,4h,9h-pyrido[3,4-b]indol-2-yl]ethanone

C16H20N2O (256.1576)


   

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)


   

14-methyl-1,4-diazapentacyclo[7.7.1.0²,¹².0³,⁸.0¹¹,¹⁶]heptadeca-3,5,7-trien-5-ol

14-methyl-1,4-diazapentacyclo[7.7.1.0²,¹².0³,⁸.0¹¹,¹⁶]heptadeca-3,5,7-trien-5-ol

C16H20N2O (256.1576)


   

1-{1-propyl-1h,3h,4h,9h-pyrido[3,4-b]indol-2-yl}ethanone

1-{1-propyl-1h,3h,4h,9h-pyrido[3,4-b]indol-2-yl}ethanone

C16H20N2O (256.1576)


   

(1r,9r,10r)-16-methyl-6,14-diazatetracyclo[7.5.3.0¹,¹⁰.0²,⁷]heptadeca-2,4,6,16-tetraen-5-ol

(1r,9r,10r)-16-methyl-6,14-diazatetracyclo[7.5.3.0¹,¹⁰.0²,⁷]heptadeca-2,4,6,16-tetraen-5-ol

C16H20N2O (256.1576)


   

2-methyl-3-[6-(methylamino)-2-azatricyclo[6.3.1.0⁴,¹²]dodeca-1(11),3,8(12),9-tetraen-7-yl]prop-2-en-1-ol

2-methyl-3-[6-(methylamino)-2-azatricyclo[6.3.1.0⁴,¹²]dodeca-1(11),3,8(12),9-tetraen-7-yl]prop-2-en-1-ol

C16H20N2O (256.1576)


   

(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)


   

(6e)-3-methyl-6-(3-methylbut-2-en-1-ylidene)-4,5-dihydro-1,3-benzodiazocin-7-ol

(6e)-3-methyl-6-(3-methylbut-2-en-1-ylidene)-4,5-dihydro-1,3-benzodiazocin-7-ol

C16H20N2O (256.1576)


   

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)


   
   

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

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

C16H20N2O (256.1576)


   

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)


   

16-methyl-6,14-diazatetracyclo[7.5.3.0¹,¹⁰.0²,⁷]heptadeca-2,4,6,16-tetraen-5-ol

16-methyl-6,14-diazatetracyclo[7.5.3.0¹,¹⁰.0²,⁷]heptadeca-2,4,6,16-tetraen-5-ol

C16H20N2O (256.1576)


   

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)


   

dihydroelymoclavine

dihydroelymoclavine

C16H20N2O (256.1576)


   

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)


   

(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)


   

13-ethenyl-11-methyl-1-(methylamino)-6-azatricyclo[7.3.1.0²,⁷]trideca-2,4,6,10-tetraen-5-ol

13-ethenyl-11-methyl-1-(methylamino)-6-azatricyclo[7.3.1.0²,⁷]trideca-2,4,6,10-tetraen-5-ol

C16H20N2O (256.1576)


   

(2s,3r,4s,7r)-4,6-dimethyl-6,11-diazatetracyclo[7.6.1.0²,⁷.0¹²,¹⁶]hexadeca-1(16),9,12,14-tetraen-3-ol

(2s,3r,4s,7r)-4,6-dimethyl-6,11-diazatetracyclo[7.6.1.0²,⁷.0¹²,¹⁶]hexadeca-1(16),9,12,14-tetraen-3-ol

C16H20N2O (256.1576)


   

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)


   

2,4-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)