Exact Mass: 306.1480538
Exact Mass Matches: 306.1480538
Found 500 metabolites which its exact mass value is equals to given mass value 306.1480538,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Tenulin
Tenulin is a sesquiterpene lactone. Tenulin is a natural product found in Helenium quadridentatum, Helenium donianum, and Helenium amarum with data available.
Isotenulin
Bz-Arg-OEt
KEIO_ID B026; [MS3] KO008890 KEIO_ID B026; [MS2] KO008889 KEIO_ID B026
Z-Gly-Pro
KEIO_ID Z003; [MS3] KO009084 KEIO_ID Z003; [MS2] KO009083 KEIO_ID Z003
N1-trans-Feruloylagmatine
N1-trans-Feruloylagmatine is found in cereals and cereal products. N1-trans-Feruloylagmatine is isolated from Triticum aestivum (wheat) exposed to low temps. Isolated from Triticum aestivum (wheat) exposed to low temps. N1-trans-Feruloylagmatine is found in wheat and cereals and cereal products.
Gaillardin
Matricin
Constituent of Matricaria chamomilla (German chamomile). Matricin is found in many foods, some of which are german camomile, fats and oils, tea, and herbs and spices. Matricin is found in fats and oils. Matricin is a constituent of Matricaria chamomilla (German chamomile).
Xanthinin
(1aalpha,2beta,3alpha,11calpha)-1a,2,3,11c-Tetrahydro-6,11-dimethylbenzo[6,7]phenanthro[3,4-b]oxirene-2,3-diol
(1aalpha,2beta,3alpha,11calpha)-1a,2,3,11c-Tetrahydro-6,11-dimethylbenzo[6,7]phenanthro[3,4-b]oxirene-2,3-diol is considered to be practically insoluble (in water) and relatively neutral
koumine
15-Ethenyl-13-methyl-19-oxa-3,13-diazahexacyclo[14.3.1.02,10.04,9.010,15.012,17]icosa-2,4,6,8-tetraene is a member of indoles. CID 5318846 is a natural product found in Gelsemium elegans with data available. Koumine is an alkaloid separated from Gelsemium elegans, shows potent anti-tumor activity. Koumine up-regulates the Bax/Bcl-2 ratio and caspase-3 expression in human breast cancer cells[1]. Koumine has anxiolytic, antistress, antipsoriatic, and analgesic activities[3], protects against the development of arthritis in Rheumatoid arthritis (RA) animal models[2]. Koumine is an alkaloid separated from Gelsemium elegans, shows potent anti-tumor activity. Koumine up-regulates the Bax/Bcl-2 ratio and caspase-3 expression in human breast cancer cells[1]. Koumine has anxiolytic, antistress, antipsoriatic, and analgesic activities[3], protects against the development of arthritis in Rheumatoid arthritis (RA) animal models[2].
Achillicin
Achillicin is found in herbs and spices. Achillicin is a constituent of Achillea millefolium (yarrow). Constituent of Achillea millefolium (yarrow). Achillicin is found in herbs and spices.
3-Oxo-14,15-dehydrorhazinilam
3-Oxo-14,15-dehydrorhazinilam is an alkaloid from Aspidosperma quebracho-blanco (quebracho). Alkaloid from Aspidosperma quebracho-blanco (quebracho)
Nb-p-Coumaroyltryptamine
Nb-p-Coumaroyltryptamine is found in cereals and cereal products. Nb-p-Coumaroyltryptamine is found in kernels of sweet corn (Zea mays). Found in kernels of sweet corn (Zea mays)
O-Isopentenylhalfordinol
O-Isopentenylhalfordinol is found in fruits. O-Isopentenylhalfordinol is an alkaloid from Aegle marmelos (bael fruit
2,5-Dibenzyl-3-hydroxy-6-methoxypyrazine
2,5-Dibenzyl-3-hydroxy-6-methoxypyrazine is found in mushrooms. 2,5-Dibenzyl-3-hydroxy-6-methoxypyrazine is isolated from fruiting bodies of the mushroom Albatrellus confluens (edibility unknown). Isolated from fruiting bodies of the mushroom Albatrellus confluens (edibility unknown). 2,5-Dibenzyl-3-hydroxy-6-methoxypyrazine is found in mushrooms.
Naematolone
Naematolone is found in mushrooms. Naematolone is a metabolite of Hypholoma capnoides (conifer tuft Metabolite of Hypholoma capnoides (conifer tuft). Naematolone is found in mushrooms.
1-(beta-D-Glucopyranosyloxy)-3-octanone
1-(beta-D-Glucopyranosyloxy)-3-octanone is found in fruits. 1-(beta-D-Glucopyranosyloxy)-3-octanone is a constituent of the fruit of Carica pubescens (mountain papaya) Constituent of the fruit of Carica pubescens (mountain papaya). 1-(beta-D-Glucopyranosyloxy)-3-octanone is found in fruits.
(+/-)-(e)-4-Ethyl-2-[(z)-hydroxyimino]-5-nitro-3-hexen-1-yl-nicotinamide
(1R,10R,12S,15S,16R,17S)-15-Ethenyl-13-methyl-19-oxa-3,13-diazahexacyclo[14.3.1.02,10.04,9.010,15.012,17]icosa-2,4,6,8-tetraene
Inproquone
C274 - Antineoplastic Agent > C186664 - Cytotoxic Chemotherapeutic Agent > C2842 - DNA Binding Agent
Propentofylline
N - Nervous system > N06 - Psychoanaleptics > N06B - Psychostimulants, agents used for adhd and nootropics > N06BC - Xanthine derivatives D002491 - Central Nervous System Agents > D018696 - Neuroprotective Agents C26170 - Protective Agent > C1509 - Neuroprotective Agent D020011 - Protective Agents
Proazulene
Proazulene, also known as matricine, is a member of the class of compounds known as gamma butyrolactones. Gamma butyrolactones are compounds containing a gamma butyrolactone moiety, which consists of an aliphatic five-member ring with four carbon atoms, one oxygen atom, and bears a ketone group on the carbon adjacent to the oxygen atom. Thus, proazulene is considered to be an isoprenoid lipid molecule. Proazulene is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Proazulene can be found in anise, which makes proazulene a potential biomarker for the consumption of this food product. Chamazulene, a blue-violet derivative of azulene, found in a variety of plants including in chamomile (Matricaria chamomilla), wormwood (Artemisia absinthium) and yarrow (Achillea millefolium) is biosynthesized from matricin .
Cumambrin A
Cumambrin a belongs to guaianolides and derivatives class of compounds. Those are diterpene lactones with a structure characterized by the presence of a gamma-lactone fused to a guaiane, forming 3,6,9-trimethyl-azuleno[4,5-b]furan-2-one or a derivative. Cumambrin a is slightly soluble (in water) and a very weakly acidic compound (based on its pKa). Cumambrin a can be found in sweet bay, which makes cumambrin a a potential biomarker for the consumption of this food product.
koumine
Annotation level-1 Koumine is an alkaloid separated from Gelsemium elegans, shows potent anti-tumor activity. Koumine up-regulates the Bax/Bcl-2 ratio and caspase-3 expression in human breast cancer cells[1]. Koumine has anxiolytic, antistress, antipsoriatic, and analgesic activities[3], protects against the development of arthritis in Rheumatoid arthritis (RA) animal models[2]. Koumine is an alkaloid separated from Gelsemium elegans, shows potent anti-tumor activity. Koumine up-regulates the Bax/Bcl-2 ratio and caspase-3 expression in human breast cancer cells[1]. Koumine has anxiolytic, antistress, antipsoriatic, and analgesic activities[3], protects against the development of arthritis in Rheumatoid arthritis (RA) animal models[2].
[3aS-(3aR*,6Z,10Z,11aS*)]-10-[(Acetyloxy)methyl]-3a,4,5,8,9,11a-hexahydro-6-(hydroxymethyl)-3-methylenecyclodeca[b]furan-2(3H)-one
3-Hydroxy-4,6,6-trimethyl-1,4-Cyclohexadiene-1-carboxaldehyde 4-hydroxy-3-methylcrotonate acetate
(1Z,3E)-14-Acetoxy-1-chlorohexadeca-1,3-diene-5,7-diyne
[3aS-(3aalpha,5abeta,7alpha,9aalpha,9balpha)]-7-(Acetyloxy)decahydro-9a-hydroxy-5a-methyl-3,9-bis(methylene)naphtho[1,2-b]furan-2(3H)-one
Ergolide
Ergolide is a sesquiterpene lactone that is decahydroazuleno[6,5-b]furan-2,5-dione substituted by methyl groups at positions 4a and 8, a methylidene group at position 3 and an acetyloxy group at position 4. It has been isolated from the aerial parts of Inula hupehensis. It has a role as a metabolite, an anti-inflammatory agent, a plant metabolite, an antineoplastic agent and a NF-kappaB inhibitor. It is a gamma-lactone, a cyclic ketone, an acetate ester, an organic heterotricyclic compound and a sesquiterpene lactone. Ergolide is a natural product found in Inula hupehensis with data available. A sesquiterpene lactone that is decahydroazuleno[6,5-b]furan-2,5-dione substituted by methyl groups at positions 4a and 8, a methylidene group at position 3 and an acetyloxy group at position 4. It has been isolated from the aerial parts of Inula hupehensis. Ergolide is a sesquiterpene lactone isolated from the dried flowers of Inula Britannica. Ergolide inhibits inducible nitric oxide synthase and cyclo-oxygenase-2 expression in RAW 264.7 macrophages through the inactivation of NF-κB[1]. Ergolide is a sesquiterpene lactone isolated from the dried flowers of Inula Britannica. Ergolide inhibits inducible nitric oxide synthase and cyclo-oxygenase-2 expression in RAW 264.7 macrophages through the inactivation of NF-κB[1].
3-Hydroxy-4,6,6-trimethyl-1,4-Cyclohexadiene-1-carboxaldehyde 2-(hydroxymethyl)crotonate acetate
Pulchellin E
Isoludalbin
[10S-(6E,10R*,11aS*)]-3-[(acetyloxy)methyl]-5,8,11,11a-Tetrahydro-6,10-dimethylcyclodeca[b]furan-2,9(4H,10H)-dione
beta-Cyclopyrethrosin
beta-Liriodenolide
Artegallin
6alpha-Acetoxy-4alpha-hydroxy-9,11(13)-guaiadien-12,8alpha-olide
gamma-Liriodenolide
[3aR-(3aalpha,5abeta,7alpha,9balpha)]-7-(Acetyloxy)-3a,4,5,5a,6,7,8,9b-octahydro-3a-hydroxy-5a,9-dimethyl-3-methylenenaphtho[1,2-b]furan-2(3H)-one
Ludalbin
2alpha-Acetoxy-8-epiivangustin
13-Acetoxy-3-hydroxy-1(10),4,7(11)-germacratrien-12,6-olide
3-Acetoxy-13-hydroxy-1(10),4,7(11)-germacratrien-12,6-olide
8alpha-Acetoxytaurin
(E,E)-5-[5-[4-(Acetyloxy)-2-methyl-2-butenyl]-2,5-dihydro-2-oxo-3-furanyl]-2-methyl-2-pentenal
Pulchellin B
Anthepseudolide acetate
Montathanolide
Asperentin-8-methyl ether
A member of the class of isocoumarins that is asperentin in which the hydroxy group at position 8 has been replaced by a methoxy group. It is a fungal metabolite isolated from Chaetomium globosum.
[4aS-(4aalpha,8beta,8abeta,9abeta)]-8-(Acetyloxy)-4a,7,8,8a,9,9a-hexahydro-9a-hydroxy-3,5,8a-trimethyl-naphtho[2,3-b]furan-2(4H)-one
alpha-Liriodenolide
propentofylline
N - Nervous system > N06 - Psychoanaleptics > N06B - Psychostimulants, agents used for adhd and nootropics > N06BC - Xanthine derivatives D002491 - Central Nervous System Agents > D018696 - Neuroprotective Agents C26170 - Protective Agent > C1509 - Neuroprotective Agent D020011 - Protective Agents
(2E)-N-(4-acetamidobutyl)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enamide
N-[2-(5-hydroxy-1H-indol-3-yl)ethyl]-3-phenyl-2-propenamide
5alpha-Acetoxy-1beta,10alpha-epoxygermacra-4(15),11-dien-12,8alpha-olid
1beta-Acetoxy-4beta,5alpha-epoxygermacra-10(14),11-dien-12,8alpha-olid
3,8b-Dimethyl-7-methylene-6-oxodecahydrooxireno[2,3:2,3]azuleno[6,5-b]furan-2a(2H)-yl acetate #
7-(3-Methylbut-2-enyloxy)flavone|7-(3-methyl-but-2-enyloxy)-2-phenyl-chromen-4-one|7-gamma,gamma-dimethylallyloxyflavanone|Cordoin-flavon
2-bromo-2,6,10-trimethylundecanoic acid
C14H27BrO2 (306.11943019999995)
2-acetylflorilenalin|florilenalin 2-O-acetate|florilenalin acetate|florilenalin-2-O-acetate
inuchinenolide B
A sesquiterpene lactone that is 3a,4,4a,5,6,7,9,9a-octahydroazuleno[6,5-b]furan-2(3H)-one substituted by a hydroxy group at position 5, methyl groups at positions 5 and 8, an acetyloxy group at position 7 and a methylidene group at position 3. It has been isolated from the aerial parts of Inula hupehensis.
(3R,4R)-(-)-6-methoxy-1-oxo-3-pentyl-3,4-dihydro-1H-isochromen-4-yl acetate|(3R,4R)-(-)-6-methoxy-3,4-dihydro-3-n-pentyl-4-acetoxy-1H-2-benzopyran-1-one|(3R,4R)-4-acetoxy-6-methoxy-3-pentylisochroman-1-one
1beta-Acetoxy-5beta,10alpha-epoxygermacra-4(15),11-dien-12,8alpha-olid
1R*,7R*,8S*,10S*-15-acetoxy-1(10)-epoxygermacra-4,11(13)-dien-8,12-olide
(3aS,5Z,9E)-6-acetoxymethyl-4c-hydroxy-10-methyl-3-methylene-(3ar,11at)-3a,4,7,8,11,11a-hexahydro-3H-cyclodeca[b]furan-2-one|artemisiifolin acetate|C15-Acetylartemisiifolin|O15-acetyl-artemisiifolin
plectranthon A|Plectranthon A ( = 3-Hydroxy-5,7,8-trimethyl-2-(prop-2-enyl)phenanthren-1,4-dion)|Plectranthone A
3beta-acetoxy-6beta-hydroxy-1(10)E,4E,7(11)-germacratriene-12,8beta-olide|nubtrienolide
15-nor-1beta,4alpha,14-trihydroxy-13-methoxy-8,11,13-podocarpatrien-7-one
8alpha-acetoxy-2alpha-hydroxy-1alpha,5alpha,6beta,7alpha,11betaH-guaia-3,10(14)-dien-12,6-olide
methyl 5,7-dimethoxy-2,2-dimethyl-2h-1-benzopyran-6-propanoate
10-acetoxy-8,9-dehydro-6-methoxy-thymol isobutyrate|10-acetoxy-8,9-dehydro-6-methoxythymol isobutyrate
3beta-acetoxy-1-oxo-germacra-5E,10(14),11(13)-trien-12-oic acid
2,3-Dihydro-3,9-dihydroxy-4-phenyl-5-methoxy-1H-phenalene
8-Ac-(1alpha,5alpha,6alpha,8alpha,10beta)-1,8-Dihydroxy-3,11(13)-guaiadien-12,6-olide
14-acetoxydesacetyl laurenobiolide|14-acetoxydesacetyl-laurenobiolide
plectranthon D|Pseudoplectranthon D ( = 3-Hydroxy-7,8,10-trimethyl-2-(prop-2-enyl)phenanthren-1,4-dion)
13-Acetoxy-3beta-hydroxygermacra-1(10)E,4E,7(11)-trien-12,6alpha-olide
(E)-1-(5-hydroxy-2,2-dimethyl-2H-chromen-6-yl)-3-phenylprop-2-en-1-one|1-(5-Hydroxy-2,2-dimethyl-2H-chromen-6-yl)-3t-phenyl-propenon|1-(5-hydroxy-2,2-dimethyl-2H-chromen-6-yl)-3t-phenyl-propenone|Lonchocarpin|lonchocarpine
2beta-acetoxy-3-oxo-eremophila-1(10),11(13)-dien-12-oic acid
1beta-acetoxy-3-oxo-eremophila-9,11(13)-dien-12-oic acid
8beta-ethoxy-9alpha-hydroxy-14-oxo-acanthospermolide
(Z)-6alpha,7alpha-epoxy-1beta-hydroxy-8-oxoeremophila-9,11-dien-13-yl acetate|xylarenone b
methyl 2-chloro-2-carboxy-6,10-dimethylundecanoate
16alpha-Chloro-17alpha-estradiol|16beta-Chloro-17alpha-estradiol
(10alphaH)-6beta-acetoxy-1alpha-hydroxyfuranoeremophilan-9-one|(4R*,4aS*,5R*,8R*,8aR*)-4,4a,5,6,7,8,8a,9-octahydro-8-hydroxy-3,4a,5-trimethyl-9-oxonaphtho[2,3-b]furan-4-yl acetate
hiiranlactone A|methyl 2-[(5R*,6S*,7aS*)-7a-methoxy-3,6-dimethyl-2-oxo-6-vinyl-2,4,5,6,7,7a-hexahydrobenzofuran-5-yl]acrylate
nigerapyrone A
A member of the class of 2-pyranones that is 2H-pyran-2-one substituted by a methoxy group at position 4 and a 4,6-dimethylbiphenyl-2-yl group at position 6. It has been isolated from an endophytic fungus, Aspergillus niger.
(1S,5S,7R,8S,10R)-14-acetoxy-4-oxopseudoguai-11(13)-en-12,8-olide
A pseudoguaianolide with anti-inflammatory activity isolated from the aerial parts of Inula hupehensis.
3-hydroxy-1-keto-3-methyl-8-methoxy-1,2,3, 4-tetrahydro-benz[alpha]anthracene
(E)-4-(3-acetoxyprop-1-enyl)-2-methoxyphenyl (S)-2-methylbutanoate
(+)-(S)-2-{7-[1-(4-hydroxyphenyl)ethyl]-4-methoxy-1H-indol-3-yl}acetonitrile
1-Ac-(1beta,8beta)-1,8-Dihydroxy-3,7(11)-eudesmadien-12,8-olide
Asperentin 6-methyl ether|Asperentin-6-O-methylaether
(5R,6R,7R,8S,10R)-8-acetoxy-15-hydroxyelema-1,3,11(13)-trien-6,12-olide
6-(3-ethoxy-2-hydroxy-3-methyl-butyl)-7-methoxy-chromen-2-one
8alpha-Acetoxy-3,4-didehydro-4,5-dihydro-5alpha-hydroxyosmitopsin
8beta-acetoxy-14-oxo-11beta,13-dihydroacanthospermolide
(1R)-2,3-dihydro-4,9-dihydroxy-8-methoxy-1-phenylphenalene|2,3-dihydro-4,9-dihydroxy-8-methoxy-1-phenylphenalene
3,5-Bis(2-hydroxy-3-methyl-3-butenyl)-4-hydroxybenzoic acid
5alpha-Acetoxy-1beta,4beta-epoxygermacra-10(14),11-dien-12,8alpha-olid
14-acetoxy-4beta-hydroxy-5alphaH-guaia-1(10),2-dien-12,6alpha-olide
(1S,5S,6S,7S,10R)-1-hydroxy-15-acetoxyeudesma-4(15),11(13)-dien-6,12-olide
3-(5-(4-(3-Methylbut-3-enoxy)phenyl)-1,3-oxazol-2-yl)pyridine
(11R)-6alpha-acetoxy-8beta-hydroxy-3-oxo-1beta-guai-4-en-12-oic acid-lactone|(11R)-6alpha-Acetoxy-8beta-hydroxy-3-oxo-1beta-guaj-4-en-12-saeure-lacton|geigerin acetate
1beta,13,14,15-tetrahydroxy-8,11,13-podocarpatrien-7-one
3beta-acetoxy-2-oxo-eremophila-1(10),11(13)-dien-12-oic acid
(E)-N-(4-acetamidobutyl)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enamide
(E)-1-(5-hydroxy-2,2-dimethylchromen-6-yl)-3-phenylprop-2-en-1-one
Fenazaquin
CONFIDENCE Reference Standard (Level 1); Source fenazaquin_30102013_12_HCD30_pos.txt
C17H22O5_Cyclodeca[b]furan-2(3H)-one, 10-[(acetyloxy)methyl]-3a,4,5,8,9,11a-hexahydro-6-(hydroxymethyl)-3-methylene-, (3aS,6Z,10Z,11aR)
C17H22O5_9a-Hydroxy-3,8a-dimethyl-5-methylene-2-oxo-2,4,4a,5,6,7,8,8a,9,9a-decahydronaphtho[2,3-b]furan-6-yl acetate
C17H22O5_3-(12-Hydroxy-5,9-dimethyl-4-oxo-8-oxatetracyclo[7.2.1.1~7,10~.0~1,6~]tridec-2-en-5-yl)propanoic acid
C17H22O5_9a-Hydroxy-3,8a-dimethyl-5-methylene-2-oxo-2,4,4a,5,6,7,8,8a,9,9a-decahydronaphtho[2,3-b]furan-8-yl acetate
C19H18N2O2_3,3-Di(1H-indol-3-yl)-1,2-propanediol
C17H22O5_(3R,3aR,4aR,7aR,8R,9aR)-3,4a,8-Trimethyl-2,5-dioxo-2,3,3a,4,4a,5,7a,8,9,9a-decahydroazuleno[6,5-b]furan-4-yl acetate
(9a-hydroxy-3,8a-dimethyl-5-methylidene-2-oxo-4,4a,6,7,8,9-hexahydrobenzo[f][1]benzofuran-8-yl) acetate
[(1R,3aR,5R,5aR,8aR,9aR)-1,5,8a-trimethyl-2,8-dioxo-3a,4,5,5a,9,9a-hexahydro-1H-azuleno[6,5-b]furan-9-yl] acetate
[(3aS,6Z,10Z,11aR)-6-(hydroxymethyl)-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-10-yl]methyl acetate
1COOH-2But-A7EO2-OCH2COOH
Literature spectrum; CONFIDENCE Tentative identification: isomers possible (Level 3); Could be alkyl homologue of given structure; Digitised from figure: approximate intensities
(E)-N-(4-acetamidobutyl)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enamide [IIN-based on: CCMSLIB00000848670]
(E)-N-(4-acetamidobutyl)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enamide [IIN-based on: CCMSLIB00000848669]
(E)-N-(4-acetamidobutyl)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enamide [IIN-based: Match]
[(1R,3aR,5R,5aR,8aR,9aR)-1,5,8a-trimethyl-2,8-dioxo-3a,4,5,5a,9,9a-hexahydro-1H-azuleno[6,5-b]furan-9-yl] acetate_major
Gly Gly Ser Ser
1-(b-D-Glucopyranosyloxy)-3-octanone
Achillicin
AQC-3
(2E)-N-(4-Acetamidobutyl)-3-(4-hydroxy-3-methoxyphenyl)acrylamide
11-dimethylarsinoyl-undecanoic acid
C13H27O3As (306.11760519999996)
(-)-1,2-BIS[(2R,5R)-2,5-DIMETHYLPHOSPHOLANO]BENZENE
3-AMINO-8-BENZYL-8-AZABICYCLO[3.2.1]OCTANE DIHYDROCHLORIDE MONOHYDRATE (3-ENDO)-
C14H24Cl2N2O (306.12655939999996)
1-BOC-4-PHENYL-PYRROLIDINE-2-CARBOTHIOIC ACID AMIDE
Ruxolitinib
D - Dermatologicals > D11 - Other dermatological preparations > D11A - Other dermatological preparations > D11AH - Agents for dermatitis, excluding corticosteroids L - Antineoplastic and immunomodulating agents > L01 - Antineoplastic agents > L01E - Protein kinase inhibitors > L01EJ - Janus-associated kinase (jak) inhibitors C274 - Antineoplastic Agent > C2189 - Signal Transduction Inhibitor > C129824 - Antineoplastic Protein Inhibitor COVID info from Guide to PHARMACOLOGY, clinicaltrial, clinicaltrials, clinical trial, clinical trials C471 - Enzyme Inhibitor > C1404 - Protein Kinase Inhibitor > C1967 - Tyrosine Kinase Inhibitor C471 - Enzyme Inhibitor > C129825 - Antineoplastic Enzyme Inhibitor > C172200 - JAK Inhibitor C274 - Antineoplastic Agent > C163758 - Targeted Therapy Agent > C125450 - JAK2 Inhibitor Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS
3-(8-(TERT-BUTOXYCARBONYL)-5,6,7,8-TETRAHYDRO-1,8-NAPHTHYRIDIN-2-YL)PROPANOIC ACID
methyl 2-[4-methoxy-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]acetate
METHYL-1-PHENETHYL-5-PHENYLIMIDAZOLE-4-CARBOXYLATE
Diethyl 3-(benzyloxy)cyclobutane-1,1-dicarboxylate
Urea, N-(5,7-dimethyl-1,8-naphthyridin-2-yl)-N-(3-methylphenyl)- (9CI)
Dodecanoic acid,2-bromo-, ethyl ester
C14H27BrO2 (306.11943019999995)
1-[2-(4-methoxyphenyl)ethyl]piperidin-4-amine,dihydrochloride
C14H24Cl2N2O (306.12655939999996)
1,3-bis(3-carboxypropyl)tetramethyldisiloxane
C12H26O5Si2 (306.13187059999996)
4-(3-Ethylthioureido)phenylboronic acid, pinacol ester
C15H23BN2O2S (306.15732080000004)
5-AMINO-5-DEOXY-2,3-O-(1-METHYLETHYLIDENE)-ADENOSINE
furan-2,5-dione compound with propane-1,2-diol and 3a,4,7,7a-tetrahydro-1H-4,7-methanoindene (1:1:1)
7-Hydroxy-6-methoxy-3-[(pivaloyloxy)methyl]-3,4-dihydroquinazolin-4-one
(E)-2-((tert-Butyldimethylsilyloxy)methyl)furo[3,2-b]pyridine-6-carbaldehyde oxime
C15H22N2O3Si (306.13996219999996)
tert-Butyl 5-fluorospiro[indoline-3,4-piperidine]-1-carboxylate
C17H23FN2O2 (306.17434699999995)
1,3-BIS-(2,3-DIHYDRO-INDOL-1-YL)-PROPANE-1,3-DIONE
2-hydroxyethyl-[2-hydroxy-3-[2-hydroxyethyl(dimethyl)azaniumyl]propyl]-dimethylazanium,dichloride
C11H28Cl2N2O3 (306.14768779999997)
1,1,3,3-Tetraethoxy-1,3-divinyldisiloxane
C12H26O5Si2 (306.13187059999996)
2-PHENYL-5-THIOCARBAMOYL-PYRROLIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER
2,2,4,4,6,6-Hexaethyl-1,3,5,2,4,6-trioxatrisilinane
(4-[4-(TERT-BUTOXYCARBONYL)PIPERAZIN-1-YL]PHENYL)BORONIC ACID
3-Ethoxy-2-(6-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)-2-methyl-3-oxopropanoic acid
tert-butyl 2,2-difluoro-3-oxo-1-oxa-4,9-diazaspiro[5.5]undecane-9-carboxylate
3-methoxy-6-methyl-1-(3,4,5-trimethoxyphenyl)pyridazin-4-one
5-dimethylamino-1-naphthalenesulfonyl-n-butylamide
2-(3,3-DIMETHYL-3,4-DIHYDRO-ISOQUINOLIN-1-YLAMINO)-4-METHYLSULFANYLBUTYRIC ACID
2,3-dimethyl-1-[(2-methylpropan-2-yl)oxycarbonyl]-3,4-dihydro-2H-quinoxaline-6-carboxylic acid
3-benzo[1,3]dioxol-5-yl-piperazine-1-carboxylic acid tert-butyl ester
2-(9-BROMONONYL-1-OXY)TETRAHYDROPYRAN
C14H27BrO2 (306.11943019999995)
Tert-Butyl 5-Fluorospiro[Indoline-3,4-Piperidine]-1-Carboxylate
C17H23FN2O2 (306.17434699999995)
1H-PYRAZOLE-4-CARBOXYLIC ACID, 5-METHYL-1,3-DIPHENYL-, ETHYL ESTER
4-[(2,4-Dimethylphenyl)azo]-2,4-dihydro-5-methyl-2-phenyl-3H-pyrazol-3-one
BENZYL 4-(METHOXY(METHYL)CARBAMOYL)PIPERIDINE-1-CARBOXYLATE
METHYL 3-ETHOXY-5-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)BENZOATE
4-[5-(4-ISOBUTYL-PHENYL)-[1,2,4]OXADIAZOL-3-YL]-BENZALDEHYDE
2-Ethoxycarbonylmethoxy-4-(3-methyl-2-butenyloxy) acetophenone
(7R,9R)-7,9-METHANO-3,8,8-TRIMETHYL-4A,5,8,9-TETRAHYDRO-1H,7H-PYRANO[4,3-B]BENZOPYRAN-1-ONE
4-(2-methoxyphenoxy)-N-(pyridin-3-ylmethyl)aniline
N-(4-Nitro-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)acetamide
(S)-tert-Butyl 2-(aminomethyl)morpholine-4-carboxylate oxalate
2-[4,5-Dihydro-4-methyl-4-(1-methylethyl)-5-oxo-1H-imidazol-2-yl]-5-ethyl-3-pyridinecarboxylic acid ammonium salt
1-methoxy-1-methyl-3-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]urea
Ethyl 4-hydroxy-1-(2-methoxyethyl)-7-methyl-2-oxo-1,2-dihydro-1,8-naphthyridine-3-carboxylate
1-(TERT-BUTOXYCARBONYL)-4-(PYRIDIN-4-YL)PIPERIDINE-4-CARBOXYLIC ACID
1-(2-{2-[(Allyloxy)methyl]-4-nitrophenoxy}ethyl)pyrrolidine
ETHYL 2-(4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)PHENOXY)ACETATE
1H-Benzotriazole,1-[(3S,5R,7aR)-hexahydro-3-phenylpyrrolo[2,1-b]oxazol-5-yl]-
tert-Butyl 4-(3-formyl-4-hydroxyphenyl)piperazine-1-carboxylate
1-(TERT-BUTOXYCARBONYL)-4-(PYRIDIN-2-YL)PIPERIDINE-4-CARBOXYLIC ACID
N-(3-PHENYL-4,5,6,7-TETRAHYDROBENZO[D]THIAZOL-2(3H)-YLIDENE)ANILINE
C19H18N2S (306.11906280000005)
2-BENZYL-1,2,3,6,7,11B-HEXAHYDRO-4H-PYRAZION[2,1-A]ISOQUINOLINE-4-ONE
5-[4-(2-METHOXY-PHENYL)-PIPERAZIN-1-YL]-5-OXO-PENTANOIC ACID
N-Isopropyl-2-nitro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline
1-(1-Piperazinyl)-3-(3,4,5-trimethoxyphenyl)-2-propen-1-one
[3-(4,4,5,5-TETRAMETHYL-[1,3,2]DIOXABOROLAN-2-YL)-PHENOXY]-ACETIC ACID ETHYL ESTER
(+)-1,2-bis-((2S,5S)-2,5-Dimethylphospholano)benzene
1-Piperazinecarboxylic acid, 4-[6-(formylamino)-3-pyridinyl]-, 1,1-dimethylethyl ester
4H-1,4-BENZODIAZEPINE-4,8-DICARBOXYLIC ACID-1,2,3,5-TETRAHYDRO-2-OXO-4-(1,1-DIMETHYLETHYL) ESTER
1-(5-Tert-butyl-2-methyl-2H-pyrazol-3-YL)-3-(4-chloro-phenyl)-urea
Deuruxolitinib
C274 - Antineoplastic Agent > C2189 - Signal Transduction Inhibitor > C129824 - Antineoplastic Protein Inhibitor C471 - Enzyme Inhibitor > C1404 - Protein Kinase Inhibitor > C1967 - Tyrosine Kinase Inhibitor C471 - Enzyme Inhibitor > C129825 - Antineoplastic Enzyme Inhibitor > C172200 - JAK Inhibitor C274 - Antineoplastic Agent > C163758 - Targeted Therapy Agent > C125450 - JAK2 Inhibitor
3-cyclopentyl-3-[4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)-1-pyrazolyl]propanenitrile
(S)-2-Amino-3-(p-hydroxyphenyl)-N-(2-naphthyl)propionamide
3-((Imino((2,2,2-trifluoroethyl)amino)methyl)amino)-1H-pyrazole-1-pentanamide
C11H17F3N6O (306.14158679999997)
(3R,4R)-(-)-6-methoxy-1-oxo-3-n-pentyl-3,4-dihydro-1H-isochromen-4-yl-acetate
A member of the class of isochromanes that is 3,4-dihydroisocoumarin substituted by an acetoxy group at position 4, a methoxy group at position 6 and a pentyl group at position 3. Isolated from Xyris pterygoblephara, it exhibits activity against dermatophyte fungi.
2-[[(4-Methyl-1-piperidinyl)-sulfanylidenemethyl]amino]benzoic acid ethyl ester
N~3~-[3-(5-Methoxypyridin-3-Yl)benzyl]pyridine-2,3-Diamine
trans-2-Hydroxyisoxypropyl-3-hydroxy-7-isopentene-2,3-dihydrobenzofuran-5-carboxylic acid
A member of the class of 1-benzofurans that is 2,3-dihydro-1-benzofuran substituted by a hydroxy group at position 3, a hydroxyisopropyl group at position 2, a carboxy group at position 5 and a prenyl group at position 7 (the 2S,3S stereoisomer) . Isolated from the rhizomes of Atractylodes lancea, it exhibits cytotoxicity against cancer cell lines HCT-116 and MKN-45.
[(1R,3S,5R,6S)-6-hydroxy-8-methyl-8-azoniabicyclo[3.2.1]octan-3-yl] (2S)-3-hydroxy-2-phenylpropanoate
(+/-)-(e)-4-Ethyl-2-[(z)-hydroxyimino]-5-nitro-3-hexen-1-yl-nicotinamide
[3-Carboxy-2-(4-carboxy-3-hydroxypentanoyl)oxypropyl]-trimethylazanium
C13H24NO7+ (306.15526939999995)
[3-Carboxy-2-(5-carboxy-3-hydroxypentanoyl)oxypropyl]-trimethylazanium
C13H24NO7+ (306.15526939999995)
[3-Carboxy-2-(3-carboxy-3-hydroxypentanoyl)oxypropyl]-trimethylazanium
C13H24NO7+ (306.15526939999995)
N-dodecanoyltaurine(1-)
A fatty acid-taurine conjugate obtained by deprotonation of the sulfonate group of N-dodecanoyltaurine; major species at pH 7.3.
6Alpha-Acetoxyisoinuviscolide
A sesquiterpene lactone that is 3a,4,4a,5,6,7,7a,9a-octahydroazuleno[6,5-b]furan-2(3H)-one substituted by a hydroxy group at position 5, methyl groups at positions 5 and 8, a methylidene group at position 3 and an acetoxy group at position 4. It has been isolated from the aerial parts of Inula hupehensis.
1-(3-Ethylphenyl)-3-(1-naphthalenyl)thiourea
C19H18N2S (306.11906280000005)
[(3S,3aR,4S,6R,9bS)-6-hydroxy-3,6,9-trimethyl-2-oxo-3,3a,4,5,8,9b-hexahydroazuleno[4,5-b]furan-4-yl] acetate
N-butan-2-yl-1-[2-(4-fluorophenyl)ethyl]-5-oxo-3-pyrrolidinecarboxamide
C17H23FN2O2 (306.17434699999995)
4-[[4-(1-Pyrrolidinyl)-2-quinazolinyl]amino]phenol
N-(2,3-dihydro-1H-inden-5-yl)-5,7-dimethyl-3-pyrazolo[1,5-a]pyrimidinecarboxamide
3-{6-[(2E)-4-hydroxy-3-methylbut-2-en-1-ylamino]-9H-purin-9-yl}-alanine
14-Hydroxyplatensic Acid
A polycyclic cage that is the 14-hydroxy derivative of platensic acid. It is isolated from Streptomyces platensis.
1-(2,3-Dihydroindol-1-yl)-2-(5-pyridin-4-yl-2-tetrazolyl)ethanone
3-(4-tert-butylphenoxy)-N-(4,5-dihydrothiazol-2-yl)propanamide
(3S)-4-oxo-3-phenyl-3-propan-2-yldiazetidine-1,2-dicarboxylic acid dimethyl ester
1-[5-[2-(tert-butylamino)-4H-1,3,4-thiadiazin-5-ylidene]-2,4-dimethyl-3-pyrrolyl]ethanone
N-[(E)-benzylideneamino]-1-ethyl-2-methylbenzimidazole-5-carboxamide
6-[1-oxo-3(R)-hydroxy-butyl]-5,7-dimethoxy-2,2-dimethyl-2H-1-benzopyran
A member of the class of chromenes that is 2H-chromene substituted by geminal methyl groups at position 2, methoxy groups at positions 5 and 7 and a (3R)-3-hydroxybutanoyl group at position 6. Isolated from the leaves of Mallotus apelta, it exhibits antineoplastic activity.
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2,6-dimethyl-4-quinolinamine
(3R)-8-[(2R,3R,5R,6S)-3,5-dihydroxy-6-methyloxan-2-yl]oxy-3-hydroxyoctanoic acid
(3R,7R)-7-[(2R,3R,5R,6S)-3,5-dihydroxy-6-methyloxan-2-yl]oxy-3-hydroxyoctanoic acid
8-(3-Phenylpropenoyl)-2,2-dimethyl-2H-1-benzopyran-7-ol
2-[(2R,3R,6S)-3-[[anilino(oxo)methyl]amino]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-6-yl]acetic acid
2-[(2S,3R,6S)-3-[[anilino(oxo)methyl]amino]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-6-yl]acetic acid
2-[(2R,3S,6R)-3-[[anilino(oxo)methyl]amino]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-6-yl]acetic acid
2-[(2S,3S,6R)-3-[[anilino(oxo)methyl]amino]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-6-yl]acetic acid
2-[(2S,3S,6S)-3-[[anilino(oxo)methyl]amino]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-6-yl]acetic acid
2-[(2R,3R,6R)-3-[[anilino(oxo)methyl]amino]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-6-yl]acetic acid
5-[(S)-alpha-Hydroxy 3,4,5-trimethoxybenzyl]-2,4-pyrimidinediamine
2-[(2E)-3,7-dimethylocta-2,6-dienyl]-3,4,6-trihydroxybenzoic acid
1-[(E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enylidene]pyrrolidin-1-ium-2-carboxylic acid
2-(4-Methylphenyl)-5-phenyltetrahydropyrrolo[3,4-c]pyrrole-1,3(2H,5H)-dione
[(3aS,10Z,11aR)-6-(hydroxymethyl)-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-10-yl]methyl acetate
Feruloylagmatine
A member of the class of cinnamamides obtained by formal condensation of the carboxy group of ferulic acid with the amino group of agmatine.
[1-[(3aR,7S,8aS)-7-methyl-3-methylidene-2-oxo-4,7,8,8a-tetrahydro-3aH-cyclohepta[b]furan-6-yl]-3-oxobutyl] acetate
[(1R,3aS,5R,5aR,8aR,9R,9aR)-1,5,8a-trimethyl-2,8-dioxo-3a,4,5,5a,9,9a-hexahydro-1H-azuleno[6,5-b]furan-9-yl] acetate
(S)-2-Amino-3-{[(E)-4-hydroxy-3-methylbut-2-enylamino]purin-9-yl}propanoic acid
(1aalpha,2beta,3alpha,11calpha)-1a,2,3,11c-Tetrahydro-6,11-dimethylbenzo[6,7]phenanthro[3,4-b]oxirene-2,3-diol
Pyridine, 3-[5-[4-[(3-methyl-2-butenyl)oxy]phenyl]-2-oxazolyl]-
L-lupinic acid zwitterion
Zwitterionic form of L-lupinic acid having an anionic carboxy group and a protonated nitrogen.
CASIN
CASIN is a selective GTPase Cdc42 inhibitor with an IC50 of 2 uM. CASIN can be used for the research of cancer[1][2].
Facinicline (hydrochloride)
Facinicline hydrochloride (RG3487 hydrochloride) is an orally active nicotinic α7 receptor partial agonist, with a Ki of 6 nM for α7 human nAChR. Facinicline hydrochloride (RG3487 hydrochloride) improves cognition and sensorimotor gating in rodents. Facinicline hydrochloride (RG3487 hydrochloride) shows high affinity (antagonist) to 5-HT3Rs with a Ki value of 1.2 nM[1].