Exact Mass: 258.1408428
Exact Mass Matches: 258.1408428
Found 500 metabolites which its exact mass value is equals to given mass value 258.1408428
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Dibutyl adipate
CONFIDENCE Reference Standard (Level 1); INTERNAL_ID 1038
Diisobutyl adipate
Diisobutyl adipate is a food additive [Goodscents]. Food additive [Goodscents]
Glycerophosphorylcholine
Acquisition and generation of the data is financially supported in part by CREST/JST. KEIO_ID G069; [MS2] KO009112 KEIO_ID G069
3-O-Methylbatatasin III
3-O-methylbatatasin III is a stilbenoid. 3-O-Methylbatatasin III is a natural product found in Coelogyne ovalis, Pleione bulbocodioides, and other organisms with data available. 3'-O-Methylbatatasin III shows spasmolytic activity[1]. 3'-O-Methylbatatasin III shows spasmolytic activity[1].
cyclo(dehydrophenylalanyl-L-leucyl)
Carbapenem biosynthesis intermediate 5
3-[(2-aminoethyl)sulfanyl]-6-ethyl-7-oxo-1-azabicyclo[3.2.0]heptane-2-carboxylic acid is a beta-lactam that is 7-oxo-1-azabicyclo[3.2.0]heptane-2-carboxylic acid carrying additional (2-aminoethyl)sulfanyl and ethyl substituents at positions 3 and 6 respectively. An intermediate in the biosynthesis of carbapenem. It has a role as a bacterial metabolite. It is a beta-lactam, an aliphatic sulfide, a monocarboxylic acid, an organic heterobicyclic compound and a primary amino compound. Carbapenem biosynthesis intermediate 5 is a natural product found in Streptomyces cattleya, Apis cerana, and Euglena gracilis with data available.
Tetradecanedioic acid
Tetradecanedioic acid, also known as 1,14-tetradecanedioate or NSC 9504, belongs to the class of organic compounds known as long-chain fatty acids. These are fatty acids with an aliphatic tail that contains between 13 and 21 carbon atoms. Tetradecanedioic acid is a very hydrophobic molecule, practically insoluble in water, and relatively neutral. Tetradecanedioic acid is a C14 dicarboxylic acid. [HMDB] Tetradecanedioic acid is an endogenous metabolite and belongs to the class of organic compounds known as long-chain fatty acids. Tetradecanedioic acid can act as a candidate biomarker for organic anion-transporting polypeptide mediated agent-agent interactions [1].
Ginsenoyne E
Ginsenoyne E is found in tea. Ginsenoyne E is isolated from Panax quinquefolium (American ginseng) and Panax ginseng (ginseng). Isolated from Panax quinquefolium (American ginseng) and Panax ginseng (ginseng). Ginsenoyne E is found in tea.
Linalyl benzoate
Linalyl benzoate is found in herbs and spices. Linalyl benzoate is found in ylang-ylang and tuberose essential oils and mushrooms. Linalyl benzoate is used in perfumery and food flavourin Found in ylang-ylang and tuberose essential oils and mushrooms. It is used in perfumery and food flavouring.
Falcarinolone
Isolated from carrot (Daucus carota) and caraway seed (Carum carvi). Falcarinolone is found in many foods, some of which are root vegetables, caraway, fats and oils, and herbs and spices. Falcarinolone is found in caraway. Falcarinolone is isolated from carrot (Daucus carota) and caraway seed (Carum carvi).
Ginsenoyne A
Ginsenoyne A is found in tea. Ginsenoyne A is isolated from ginseng. Isolated from ginseng. Ginsenoyne A is found in tea.
Flavidulol B
Flavidulol B is found in mushrooms. Flavidulol B is isolated from the edible but bitter tasting Japanese kihatsudake mushroom (Lactarius flavidulus). Isolated from the edible but bitter tasting Japanese kihatsudake mushroom (Lactarius flavidulus). Flavidulol B is found in mushrooms.
Flavidulol A
Flavidulol A is found in mushrooms. Flavidulol A is isolated from the edible but bitter tasting Japanese kihatsudake mushroom (Lactarius flavidulus). Isolated from the edible but bitter tasting Japanese kihatsudake mushroom (Lactarius flavidulus). Flavidulol A is found in mushrooms.
(all-E)-1,8,10-Heptadecatriene-4,6-diyne-3,12-diol
(all-E)-1,8,10-Heptadecatriene-4,6-diyne-3,12-diol is found in tea. (all-E)-1,8,10-Heptadecatriene-4,6-diyne-3,12-diol is a constituent of ginseng. Constituent of ginseng. (all-E)-1,8,10-Heptadecatriene-4,6-diyne-3,12-diol is found in tea.
gamma-L-Glutamyl-L-pipecolic acid
gamma-L-Glutamyl-L-pipecolic acid is found in green vegetables. gamma-L-Glutamyl-L-pipecolic acid is isolated from the seeds of Gleditisia caspica (Caspian locust). Isolated from the seeds of Gleditisia caspica (Caspian locust). gamma-L-Glutamyl-L-pipecolic acid is found in green vegetables.
Strobilurin A
Strobilurin A is found in mushrooms. Strobilurin A is produced by Oudemansiella mucida, (porcelain fungus) and many other fung D010575 - Pesticides > D005659 - Fungicides, Industrial > D000073739 - Strobilurins D000890 - Anti-Infective Agents > D000935 - Antifungal Agents
Geranyl benzoate
Geranyl benzoate is a flavouring ingredient. Flavouring ingredient
(2S,2'S)-Pyrosaccharopine
(2S,2S)-Pyrosaccharopine is found in cereals and cereal products. (2S,2S)-Pyrosaccharopine is isolated from edible dried shiitake mushroom (Lentinus edodes) and buckwheat seeds (Fagopyrum esculentum). Isolated from edible dried shiitake mushroom (Lentinus edodes) and buckwheat seeds (Fagopyrum esculentum). (2S,2S)-Pyrosaccharopine is found in mushrooms and cereals and cereal products.
1,1'-(Tetrahydro-6a-hydroxy-2,3a,5-trimethylfuro[2,3-d]-1,3-dioxole-2,5-diyl)bis-ethanone
1,1-(Tetrahydro-6a-hydroxy-2,3a,5-trimethylfuro[2,3-d]-1,3-dioxole-2,5-diyl)bis-ethanone is used as a food additive [EAFUS] ("EAFUS: Everything Added to Food in the United States. [http://www.eafus.com/]")
Diethyl decanedioate
Diethyl decanedioate is a flavouring ingredient. Flavouring ingredient
2-Hydroxypropyl 2-isopropyl-5-methylcyclohexyl carbonate
2-Hydroxypropyl 2-isopropyl-5-methylcyclohexyl carbonate belongs to the family of Monocyclic Monoterpenes. These are monoterpenes containing 1 ring in the isoprene chain
1-Hydroxypropan-2-yl 2-isopropyl-5-methylcyclohexyl carbonate
1-Hydroxypropan-2-yl 2-isopropyl-5-methylcyclohexyl carbonate belongs to the family of Monocyclic Monoterpenes. These are monoterpenes containing 1 ring in the isoprene chain.
2-Naphthylaminomethyl-gamma-aminobutyric acid
6-Nitroquipazine
D018377 - Neurotransmitter Agents > D018490 - Serotonin Agents > D012702 - Serotonin Antagonists
Biotin hydrazide
C10H18N4O2S (258.11504080000003)
L-enantiomer
5-Methyl-4-((1R,6R)-3-methyl-6-(1-methylethenyl)-2-cyclohexen-1-yl)-1,3-benzenediol
8-Hydroxyfalcarinone
8-hydroxyfalcarinone is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). 8-hydroxyfalcarinone can be found in wild celery, which makes 8-hydroxyfalcarinone a potential biomarker for the consumption of this food product.
Acetyl dehydrorishitinol
Acetyl dehydrorishitinol is a member of the class of compounds known as naphthalenes. Naphthalenes are compounds containing a naphthalene moiety, which consists of two fused benzene rings. Acetyl dehydrorishitinol is practically insoluble (in water) and an extremely weak basic (essentially neutral) compound (based on its pKa). Acetyl dehydrorishitinol can be found in potato, which makes acetyl dehydrorishitinol a potential biomarker for the consumption of this food product.
1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol benzoate
Flavouring compound [Flavornet]
(E)-2-(1,5-Dimethyl-1,4-hexadienyl)-5-methyl-phenol acetate
1,4-Dihydro-4-oxo-3-(2-pyrrolidinyl)-2-quinolinecarboxylic acid
C14H14N2O3 (258.10043740000003)
1-Acetyl-3-carboxy-tetrahydro-beta-carboline
C14H14N2O3 (258.10043740000003)
2,7-dimethyl-2-(4-methyl-3-penten-1-yl)-2H-1-benzopyran-5-ol
6E,8E,12E,14E-Hexadecatetraen-10-insaeuremethylester|Me ester-(all-E)-6,8,12,14-Hexadecatetraen-10-ynoic acid
(3S, 8S)-16,17-dehydrofalcarindiol|1,9(Z),16-heptadecatriene-4,6-diyne-3,8-diol|cis-1,9,16-heptadecatriene-4,6-diyne-3,8-diol|cis-16,17-didehydro-falcarindiol|cis-dehydrofalcarindiol|Dehydrofalcarindiol|Heptadeca-1,9(Z),16-trien-4,6-diyn-3,8-diol|heptadeca-1,9c,16-triene-4,6-diyne-3,8-diol
cis-8,9-Epoxy-heptadeca-1,15-dien-11,13-diin-10-ol
6R-Hydroxy-(4R,6R)-Tetrahydro-4-hydroxy-6-nonyl-2H-pyran-2-one
acetic acid 4-acetoxy-6-hydroxy-1-(2-hydroxyethyl)hexa-1,3-dienyl ester|citrantifidiene
(+)-3-acetoxy-tetradeca-4t,6t,12t-triene-8,10-diyn-1-ol|3-Acetoxy-tetradecatrien-(4,6,12)-diin-(8,10)-ol-(1) (3R?)-3-Acetoxy-tetradeca-4t,6t,12t-trien-8,10-diin-1-ol
2,6-Diamino-2,3,4,6-tetradeoxy-erythro-hexose,9CI,8CI-Me glycoside, 2,6-di-N-Ac,6-N-Me
(2E,5E)-2-methyl-6-(7-oxo-3-methylocta-2,5-dienyl)-1,4-benzoquinone
3(2-pyrrolidinyl)-KYNA|3-(2-pyrrolidinyl)-kynurenic acid
C14H14N2O3 (258.10043740000003)
(+/-)-lycoposerramine R|(4aS,6R,7aS,12bS)-1,2,3,4,4a,5,6,7,7a,8-decahydro-6-methylpyrido[2,3:4,5]-cyclopenta[1,2-c]-quinolin-10(9H)-one|lycoposerramine-R
3-(3,3-dimethyl-2-propenyl)-4-methoxy-5-phenyl-2(5H)-furanone
nigerazine B
An enamide obtained by formal condensation of the carboxy group of trans-cinnamic acid with the secondary amino group of (2S,5R)-1,2,5-trimethylpiperazine.
Debromlaurinterolacetat|debromolaurinterol acetate
1-acetoxy-3-(trans-3-nona-1t,7t-diene-3,5-diynyl-oxiranyl)-propane|1-Acetoxy-4,5-epoxy-tetradeca-8,10-diin-6,12-dien
(Z)-15-Hydroxy-9,16-heptadecadiene-11,13-diyn-8-one
(4S,6S)-4-hydroxy-3-methoxy-6-(1-phenyl-2-propenyl)-2-cyclohexene-1-one
15-hydroxy-heptadeca-8c,16-diene-11,13-diyn-7-one|Heptadeca-1,8c-dien-4,6-diin-3-ol-10-on
Debromoisolaurinterol|debromoisolaurinterol acetate
(E,E)-17-Hydroxy-7,9-heptadecadiene-11,13-diyn-6-one
gamma-L-glutamyl-L(+)-2-amino-3-methylenepentenoic acid
(E,E)-17-Hydroxy-7,9-heptadecadiene-11,13-diyn-4-one|17-hydroxy-heptadeca-7t,9t-diene-11,13-diyn-4-one
Tensyuic acid B
A tensyuic acid that is itaconic acid which has been substituted at position 3 by a 5-(methoxycarbonyl)pentyl group. The (-)-isomer, isolated from Aspergillus niger FKI-2342.
(2E)-2-(3,7-dimethylocta-2,6-dienyl)-6-methyl-2,5-cyclohexadiene-1,4-dione|1,4-Quinone-(E)-2-(3,7-Dimethyl-2,6-octadienyl)-6-methyl-1,4-benzenediol
dimethyl 2-(6-hydroxyhexyl)-3-methylenesuccinic acid
1-[(2-Methylene-3-oxo-4,5-dimethyl-4-cyclopentene)-1-ylmethyl]-3,4-dimethyl-3-cyclopentene-2,5-dione
(4S)-4,10,11-trihydroxy-10-methyldodec-2-en-1,4-olide
De-N-methyl-beta-obscurine|des-N-methyl-beta-obscurine|huperzine B|N-demethyl-beta-obscurine
(3S,6S)-1,4-dihydroxy-3,6-bis<(1R)-1-methylpropyl>piperazine-2,5-dione (terramide A)|(3S,6S)-1,4-dihydroxy-3,6-bis[(1R)-1-methylpropyl]piperazine-2,5-dione (terramide A)|terramide A
(2S,3R,5S)-(-)-2,3-dihydroxytetradecan-5-olide|(3S,4R,6S)-3,4-dihydroxy-6-nonyltetrahydro-2H-pyran-2-one|2,3-dihydroxy-5-nonyltetrahydro-2H-pyranone|2,3-dihydroxytetradecan-5-olide
4-hydroxy-3-methoxy-4-(3-phenyl-2-propenyl)-2-cyclohexene-1-one
2-Acetyl-5-(3-methyl-2-butenyl)-6-methoxybenzofuran
4-hydroxy-3,5,5-trimethyl-4-(1,2,3-trihydroxybutyl)cyclohex-2-enone|angelicol A
(+-)-1-Acetoxy-tetradeca-4,6,12-trien-8,10-diin-3-ol
(9Z,11Z)-heptadeca-1,9,11-triene-4,6-diyne-3,8-diol
1-(4-Methoxy-9H-pyrido[3,4-b]indol-1-yl)ethane-1,2-diol
C14H14N2O3 (258.10043740000003)
Ac-(E,E)-form-9-(Tetrahydropyran-2-yl)-2,8-nonadiene-4,6-diyn-1-ol
2,6-Diamino-2,3,4,6-tetradeoxy-erythro-hexose,9CI,8CI-Et glycoside, 2,6-di-N-Ac
trans-7,9-dihydroxy-3-methyl-8-oxo-dodecan-4-olide
2-Thioxo-5-ethyl-5-(3-hydroxy-3-methylbutyl)-2,3-dihydropyrimidine-4,6(1H,5H)-dione
3-Methoxy-7-hydroxy-cadalenal|3-Methoxy-7-hydroxycadalenal|3-Methoxy-7-hydroxycadenal
erythro-1-(2-methoxyphenyl)-3-phenylpropane-1,2-diol|threo-1-(2-methoxyphenyl)-3-phenylpropane-1,2-diol
dimethyl 2-(5-hydroxyhexyl)-3-methylenesuccinic acid
4-(Hydroxymethyl)-3-(1-hydroxy-7-methyloctyl)oxolan-2-one
O8-Me-8-Hydroxy-1(6),2,4,7(11)-cadinatetraen-12,8-olide
(-)-sequosempervirin A|(4R)-4-(4-hydroxybenzyl)spiro[4,5]dec-1-en-8-ol|(4R,5r,8R)-4-(4-hydroxybenzyl)spiro[4.5]dec-1-en-8-ol|sequosempervirin A
44SF3SS9W7
2-[3-(4-Hydroxyphenyl)propyl]-5-methoxyphenol is a natural product found in Broussonetia papyrifera and Anemarrhena asphodeloides with data available.
sn-Glycero-3-phosphocholine 1:1 cadmium chloride adduct
2-methoxy-5-methyl-3-(2-methylbut-3-en-2-yl)chromen-4-one
methyl 11-hydroxy-10-methyl-4-oxododecanoate
2-methoxy-5-methyl-3-(2-methylbut-3-en-2-yl)chromen-4-one
2-methoxy-5-methyl-3-(2-methylbut-3-en-2-yl)chromen-4-one [IIN-based on: CCMSLIB00000846302]
2-methoxy-5-methyl-3-(2-methylbut-3-en-2-yl)chromen-4-one [IIN-based: Match]
(E)-2-methyl-4-((3aS)-1-methyl-2,3,8,8a-tetrahydropyrrolo[2,3-b]indol-3a(1H)-yl)but-2-en-1-ol
Mucidin
An enoate ester that is the methyl ester of (2E,3Z,5E)-2-(methoxymethylene)-3-methyl-6-phenylhexa-3,5-dienoic acid. D010575 - Pesticides > D005659 - Fungicides, Industrial > D000073739 - Strobilurins D000890 - Anti-Infective Agents > D000935 - Antifungal Agents
Diacetyl trimer
Geranyl benzoate
A benzoate ester resulting from the formal condensation of the carboxy group of benzoic acid with the hydroxy group of geraniol.
Flavidulol B
(all-E)-1,8,10-Heptadecatriene-4,6-diyne-3,12-diol
2-METHYL-6-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-1H-BENZO[D]IMIDAZOLE
1-(1H-Indol-3-ylmethyl)piperidine-4-carboxylic acid
Shi epoxidation catalyst, L-enantiomer
Ethyl 4-(5-Cyclopropyl-1,2,4-oxadiazol-3-yl)benzoate
C14H14N2O3 (258.10043740000003)
6-BENZOYL-3,4-DIMETHYL-3-CYCLOHEXENE-1-CARBOXYLIC ACID
Lorbamate
C78272 - Agent Affecting Nervous System > C29756 - Sedative and Hypnotic
1-[4-(4-MORPHOLINYL)PHENYL]-1H-PYRROLE-2,5-DIONE
C14H14N2O3 (258.10043740000003)
ethyl 2,5-dimethyl-1-(pyridin-4-ylmethyl)pyrrole-3-carboxylate
trans-2-(4-Ethylphenyl)vinylboronic acid pinacol ester
12-OXO-6,7,8,9,10,12-HEXAHYDRO-AZEPINO[2,1-B]QUINAZOLINE-3-CARBOXYLIC ACID
C14H14N2O3 (258.10043740000003)
5-Methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrrolo[2,3-b]pyridine
2-methyl-4-(tetramethyl-1,3,2-dioxaborolan-2-yl)-2H-indazole
2-METHYL-5-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-2H-INDAZOLE
3-methyl-5-(tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indazole
tert-butyl 6-cyano-3,4-dihydroisoquinoline-2(1H)-carboxylate
1-N-CBZ-2-Methylpropane-1,2-diamine-HCl
C12H19ClN2O2 (258.11349839999997)
2-N-Cbz-2-Methylpropane-1,2-diamine hydrochloride
C12H19ClN2O2 (258.11349839999997)
METHYL 1-CYCLOHEXYL-1H-BENZO[D]IMIDAZOLE-5-CARBOXYLATE
Methyl 1-cyclohexyl-1H-benzo[d]imidazole-6-carboxylate
2-[(4-methylpiperazin-1-yl)methyl]-1H-quinazolin-4-one
3-AMINO-3-(4-DIMETHYLAMINO-NAPHTHALEN-1-YL)-PROPIONIC ACID
benzyl N-(6-methyl-2-oxo-1H-pyridin-3-yl)carbamate
C14H14N2O3 (258.10043740000003)
3-methyl-5-(tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrrolo[2,3-b]pyridine
2-methyl-5-(tetramethyl-1,3,2-dioxaborolan-2-yl)-1h-pyrrolo[2,3-b]pyridine
4,4,5,5-Tetramethyl-2-(2,3,4-trifluorophenyl)-1,3,2-dioxaborolane
1-METHYL-4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-1H-INDAZOLE
(2S, 4R)-Boc-4-amino Pyrrolidine-2-carboxylate acid ethylester-HCl
Amino(1-{[(2-methyl-2-propanyl)oxy]carbonyl}-4-piperidinyl)acetic acid
4,4,5,5-tetramethyl-2-(2,4,5-trifluorophenyl)-1,3,2-dioxaborolane
(R)-1-tert-Butyl 2-ethyl piperazine-1,2-dicarboxylate
1-Boc-4-methylpiperidine-4-carboxylic acid methyl ester
Benzyl n-(4-aminobutyl)carbamate hydrochloride
C12H19ClN2O2 (258.11349839999997)
3-Pyridazinecarboxamide, 6-[[(4-methoxyphenyl)methyl]amino]-
3-[(ETHOXYCARBONYL)OXYCARBONYL]-2,5-DIHYDRO-2,2,5,5-TETRAMETHYL-1H-PYRROL-1-YLOXY
Benzyl (4-methoxypyridin-2-yl)carbamate
C14H14N2O3 (258.10043740000003)
(R)-3-METHOXYCARBONYLMETHYL-PIPERAZINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER
5-CYANOAMINO-INDAZOLE-1-CARBOXYLIC ACID TERT-BUTYL ESTER
(4aS-cis)-4,4a,5,6,7,8-Hexahydro-1,4a-dimethyl-7-(1-methylethenyl)-2(3H)-naphthalenone
3a,4,5,6,7,7a-hexahydro-2-benzofuran-1,3-dione,2,2-dimethylpropane-1,3-diol
1-(methoxymethyl)-4-[4-(methoxymethyl)phenoxy]benzene
Aspartic acid beta-naphthylamide
C14H14N2O3 (258.10043740000003)
D018377 - Neurotransmitter Agents > D018846 - Excitatory Amino Acids
7-ISOPROPOXY-6-METHOXY-4-OXO-1,4-DIHYDROQUINOLINE-3-CARBONITRILE
C14H14N2O3 (258.10043740000003)
(R,R)-7-AMINO-3-(1-METHYLPYRROLIDINIO)METHYL-3-CEPHEM-4-CARBOXYLATEHCL
C14H14N2O3 (258.10043740000003)
4-[(E)-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)ethenyl]benzaldehyde
C15H19BO3 (258.14271740000004)
(2,2-DIMETHYL-1-PYRROLIDIN-1-YLMETHYL-PROPYL)-METHYL-CARBAMICACIDBENZYLESTER
formaldehyde,4-[2-(4-hydroxyphenyl)propan-2-yl]phenol
4-CARBOXYMETHYL-3-OXO-PIPERAZINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER
1-oxo-2,3,4,9-tetrahydro-1h-b-carboline-6-carboxylic acid ethyl ester
C14H14N2O3 (258.10043740000003)
a-D-erythro-Hex-2-enopyranoside,ethyl 2,3-dideoxy-, 4,6-diacetate
ethyl 3-(6-methylpyrazin-2-yl)oxybenzoate
C14H14N2O3 (258.10043740000003)
2-methyl-7-(tetramethyl-1,3,2-dioxaborolan-2-yl)-2H-indazole
6,7-Diethoxy-4-oxo-1,4-dihydro-3-quinolinecarbonitrile
C14H14N2O3 (258.10043740000003)
3-(4-METHYL-6-OXO-2-PHENYL-1,6-DIHYDROPYRIMIDIN-5-YL)PROPANOIC ACID
C14H14N2O3 (258.10043740000003)
3-formyll-trans-beta-styrylboronic acid pinacol ester
C15H19BO3 (258.14271740000004)
N-[4-[1-hydroxy-2-(methylamino)propyl]phenyl]methanesulfonamide
2-(4-([(TERT-BUTOXY)CARBONYL]AMINO)PIPERIDIN-1-YL)ACETIC ACID
1-methyl-5-(tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indazole
2-methyl-6-(tetramethyl-1,3,2-dioxaborolan-2-yl)-2H-indazole
7-BENZYL-1,4-DIOXA-7-AZASPIRO[4.5]DECANE-8-CARBONITRILE
7-Isopropoxy-6-methoxy-4-oxo-3,4-dihydro-3-quinolinecarbonitrile
C14H14N2O3 (258.10043740000003)
2-CYCLOPENTYL-5-METHOXY-6,7-DIMETHYL-2,3-DIHYDRO-1H-INDEN-1-ONE
(S)-3-METHOXYCARBONYLMETHYL-PIPERAZINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER
Pentalene, 1,3a,4,6a-tetrahydro-3,6-diphenyl-, (3aR,6aR)
ethyl 4-(6-methylpyridazin-3-yl)oxybenzoate
C14H14N2O3 (258.10043740000003)
4-(2,3-dihydrospiro[indene-1,2-pyrrolidine]-6-yl)Morpholine
(3R,4S)-REL-1-TERT-BUTYL 3-ETHYL 4-AMINOPYRROLIDINE-1,3-DICARBOXYLATE
4-MethoxycarbonylMethyl-piperazine-1-carboxylic acid tert-butyl ester
1-Boc-3(R )-(methoxycarbonylmethyl-amino)pyrrolidine
(2S,4S)-1-tert-butyl 2-Methyl 4-(aminomethyl)pyrrolidine-1,2-dicarboxylate
(2S,4R)-1-tert-butyl 2-Methyl 4-(aminomethyl)pyrrolidine-1,2-dicarboxylate
4,4,5,5-tetramethyl-2-(2,4,6-trifluorophenyl)-1,3,2-dioxaborolane
3-(1-tert-butoxycarbonylpiperazin-4-yl)propionic acid
TERT-BUTYL (4-(2-HYDROXYPROPAN-2-YL)THIAZOL-2-YL)CARBAMATE
(1S,2R)-2-[[2-(hydroxyamino)-2-oxoethyl]-methylcarbamoyl]cyclohexane-1-carboxylic acid
TERT-BUTYL 2-(2-METHOXY-2-OXOETHYL)PIPERAZINE-1-CARBOXYLATE
2-cyclopentyl-1-(4-methoxy-2,3-dimethylphenyl)prop-2-en-1-one
(3AS,4R,6R,7AS)-TETRAHYDRO-4-HYDROXYMETHYL-6-METHOXY-4H-FURO[3,2-C]PYRAN-2(3H)-ONE
tert-butyl 2-(2-chloroethyl)-2-cyanopyrrolidine-1-carboxylate
C12H19ClN2O2 (258.11349839999997)
(2Z,8E,10E)-heptadeca-2,8,10-trien-4,6-diyne-1,14-diol
O,O-Di(ethyl-d10) O-(2-pyrazinyl) phosphorothioate
2-((TERT-BUTOXYCARBONYL)AMINO)-2-(PIPERIDIN-4-YL)ACETIC ACID
1H-1-Benzazepine-1-carboxamide,N-cyclopentyl-2,3,4,5-tetrahydro-(9CI)
trans-4-Boc-amino-piperidine-3-carboxylic acid Methyl ester
2-AMINO-2-(1-(TERT-BUTOXYCARBONYL)PIPERIDIN-4-YL)ACETIC ACID
1-propan-2-yl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylic acid
1-(5-HYDROXY-3-METHYL-1-PHENYL-1H-PYRAZOL-4-YL)BUTANE-1,3-DIONE
C14H14N2O3 (258.10043740000003)
(S)-2-(3-((TERT-BUTOXYCARBONYL)AMINO)-2-OXOPYRROLIDIN-1-YL)ACETIC ACID
Pelubiprofen
C78272 - Agent Affecting Nervous System > C241 - Analgesic Agent > C2198 - Nonnarcotic Analgesic
N-[(4-Aminophenyl)methyl]carbamic acid 1,1-dimethylethyl ester hydrochloride
C12H19ClN2O2 (258.11349839999997)
(+)-1,2-bis((2r,5r)-2,5-dimethylphospholano)ethane
1,2:5,6-di-o-isopropylidene-alpha-d-ribo-3-hexulofuranose
2-(1-(TERT-BUTOXYCARBONYL)-3-OXOPIPERAZIN-2-YL)ACETIC ACID
Poly(propylene glycol) 4-nonylphenyl ether acrylate
N-[(1S)-4-Cyano-2,3-dihydro-1H-inden-1-yl]carbamic acid 1,1-dimethylethyl ester
tert-Butyl (4R-cis)-6-formaldehydel-2,2-dimethyl-1,3-dioxane-4-acetate
(1R,4R)-N-(3-Fluoro-benzyl)-cyclohexane-1,4-diaMine hydrochloride
methyl2-((1R,3R)-3-amino-1-hydroxy-4-methylpentyl)thiazole-4-carboxylate
(S)-tert-butyl (4-cyano-2,3-dihydro-1H-inden-1-yl)carbamate
[1-(6-Methoxy-pyriMidin-4-yl)-piperidin-4-yl]-Methyl-aMine hydrochloride
(1R,4R)-N-(2-Fluoro-benzyl)-cyclohexane-1,4-diaMine hydrochloride
(1r,4r)-N1-(4-fluorobenzyl)cyclohexane-1,4-diamine hydrochloride
1-methyl-6-(tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indazole
TERT-BUTYL 3-AMINO-5-CYANO-1H-INDAZOLE-1-CARBOXYLATE
6-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-2,3-DIHYDROINDEN-1-ONE
C15H19BO3 (258.14271740000004)
3-(1-BENZYL-3,5-DIMETHYL-1 H-PYRAZOL-4-YL)-PROPIONIC ACID
(3aS,6aS)-3,6-diphenyl-1,3a,4,6a-tetrahydropentalene
METHYL 4-((TERT-BUTOXYCARBONYL)AMINO)PIPERIDINE-4-CARBOXYLATE
1-(3,4-Dimethoxyphenyl)piperazine hydrochloride
C12H19ClN2O2 (258.11349839999997)
2-(1-tert-Butoxycarbonylpiperazin-4-yl)propionic acid
n-(tert-butoxycarbonyl)-l-proline n-methoxy-n-methylamide
Propoxate
C78272 - Agent Affecting Nervous System > C29756 - Sedative and Hypnotic
1-Cbz-Amino-3-methylaminopropane hydrochloride
C12H19ClN2O2 (258.11349839999997)
1-N-Cbz-1-N-Methyl-1,3-diaminopropane hydrochloride
C12H19ClN2O2 (258.11349839999997)
(-)-1,2-bis-((2S,5S)-2,5-Dimethylphospholano)ethane
buta-1,3-diene, methyl 2-methylprop-2-enoate, styrene
2-(4-AMINO-1-(TERT-BUTOXYCARBONYL)PIPERIDIN-4-YL)ACETIC ACID
6-(2-Oxo-hexahydro-thieno[3,4-D]imidazol-4-YL)-hexanoic acid
tert-Butyl 2-(methoxy(methyl)carbamoyl)pyrrolidine-1-carboxylate
(2E)-3-phenyl-1-[(2R,5S)-2,4,5-trimethylpiperazin-1-yl]prop-2-en-1-one
2,7-Dimethyl-2-(4-methyl-3-pentenyl)-2H-1-benzopyran-5-ol
1-Methoxy-4-[(4-methoxyphenyl)methoxymethyl]benzene
Cyclopenta(c)pyrido(3,2-a)carbazole, 1,2,3,8-tetrahydro-
Methacrylic 10-mercapto-1-decanyl ester
C14H26O2S (258.16534160000003)
4-[(1s,2r,5s)-4,4,8-Trimethyl-3-Oxabicyclo[3.3.1]non-7-En-2-Yl]phenol
methyl (2S)-2-(2-fluorobiphenyl-4-yl)propanoate
C16H15FO2 (258.10560219999996)
56684-87-8
3'-O-Methylbatatasin III shows spasmolytic activity[1]. 3'-O-Methylbatatasin III shows spasmolytic activity[1].
1,2,3,4,7,8,9,10-Octahydro[1]benzothieno[2,3-b]quinolin-11-amine
(3Z)-3-benzylidene-6-(2-methylpropyl)piperazine-2,5-dione
1,4-Dihydroxy-3,6-bis(2-methylpropyl)pyrazine-1,4-diium-2,5-diol
(5R)-6-(2-amino-1-carbamoyl-4,5-dihydroimidazol-4-yl)-5-hydroxyhexanoic acid
[3-carboxy-2-[(E)-hex-4-enoyl]oxypropyl]-trimethylazanium
2-[4-[(Z)-(2-oxocyclohexylidene)methyl]phenyl]propanoic acid
[3-carboxy-2-[(E)-hex-2-enoyl]oxypropyl]-trimethylazanium
[3-carboxy-2-[(E)-hex-3-enoyl]oxypropyl]-trimethylazanium
[(E)-2-(carboxymethyl)-2-hydroxy-3-oxooct-4-enyl]-trimethylazanium
N-{(E)-amino[(5-methyl-1,3-benzoxazol-2-yl)amino]methylidene}cyclopropanecarboxamide
4-tert-butylbenzaldehyde (4-amino-4H-1,2,4-triazol-3-yl)hydrazone
4-[3-[oxo(1-pyrrolidinyl)methyl]-2H-isoxazol-5-ylidene]-1-cyclohexa-2,5-dienone
C14H14N2O3 (258.10043740000003)
Mimosifolenone
A cyclic ketone that is cyclohept-2-en-1-one substituted by a hydroxy group at position 5, a methoxy group at position 6 and a 2-phenylethenyl group at position 5 (the 5R,6R stereoisomers). Isolated from the rootwood of Aeschynomene mimosifolia, it exhibits cytotoxic towards human cancer cell lines.
Indolmycin(1+)
An organic cation obtained by protonation at position 3 in the oxazole ring of indolmycin. It is the major microspecies at pH 7.3 (according to Marvin v 6.2.0.).
(1,4,8,11-Tetraazacyclotetradecane)nickel(2+)
C10H24N4Ni+2 (258.13543339999995)
(4-Methoxyphenyl)-(3-methyl-2-propyl-4-imidazolyl)methanone
(2E)-3-phenyl-1-[(2R,5R)-2,4,5-trimethylpiperazin-1-yl]prop-2-en-1-one
N-[(E)-(5-hydroxy-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylidene]acetohydrazide
(2E)-2-[(3-nitrophenyl)methylidene]-1-azabicyclo[2.2.2]octan-3-one
C14H14N2O3 (258.10043740000003)
5-methyl-2-[(6R)-3-methyl-6-prop-1-en-2-ylcyclohex-2-en-1-yl]benzene-1,3-diol
1-[5-Amino-3-(2-methylphenyl)-1,2,4-triazol-1-yl]-2,2-dimethylpropan-1-one
2-[1,3-Dihydroxypropan-2-yloxy(hydroxy)phosphoryl]oxyethyl-trimethylazanium
3-Hydroxy-1-oxo-1-[2-(2,3,4-trihydroxybenzyl)hydrazinyl]propan-2-aminium
C10H16N3O5+ (258.10899059999997)
2-[[(2S)-2,3-dihydroxypropoxy]-hydroxyphosphoryl]oxyethyl-trimethylazanium
4-(Hydroxyimino)-2,2,6,6-tetramethyl-1-piperidinol, TMS derivative
Methyl 2-(N-((4S)-4-(2-methylpropyl)-2-oxazolidinone-3-carbamoyl))aminoacetate
Methyl 2-(N-((4S)-4-(1,1-dimethylethyl)-2-oxazolidinone-3-carbamoyl))aminoacetate
2-(4-Methylphenyl)-4,4-dimethyltetrahydropyrrolo[3,4-c]pyrrole-1,3(2H,5H)-dione
Ethyl (4R*,5R*)-(E)-5-hydroxy-4-(2-tetrahydropyranyl)oxy-2-hexenoate
2-(((R)-2,3-Dihydroxypropyl)phosphoryloxy)-N,N,N-trimethylethanaminium
1,1-(Tetrahydro-6a-hydroxy-2,3a,5-trimethylfuro[2,3-d]-1,3-dioxole-2,5-diyl)bis-ethanone
6-Nitroquipazine
D018377 - Neurotransmitter Agents > D018490 - Serotonin Agents > D012702 - Serotonin Antagonists
nigerazine A
An enamide obtained by formal condensation of the carboxy group of trans-cinnamic acid with the secondary amino group of (2R,5R)-1,2,5-trimethylpiperazine.
3-[(2-aminoethyl)sulfanyl]-6-ethyl-7-oxo-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
A beta-lactam that is 7-oxo-1-azabicyclo[3.2.0]heptane-2-carboxylic acid carrying additional (2-aminoethyl)sulfanyl and ethyl substituents at positions 3 and 6 respectively. An intermediate in the biosynthesis of carbapenem.