Exact Mass: 350.1761
Exact Mass Matches: 350.1761
Found 500 metabolites which its exact mass value is equals to given mass value 350.1761
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
(1R)-trans-Phenothrin
Fenugrin a, also known as sumithrin or phenothrin, (1s-cis)-isomer, is a member of the class of compounds known as pyrethroids. Pyrethroids are organic compounds similar to the pyrethrins. Some pyrethroids containing a chrysanthemic acid esterified with a cyclopentenone (pyrethrins), or with a phenoxybenzyl group. Fenugrin a is practically insoluble (in water) and an extremely weak basic (essentially neutral) compound (based on its pKa). Fenugrin a can be found in fenugreek, which makes fenugrin a a potential biomarker for the consumption of this food product. Fenugrin a is a non-carcinogenic (not listed by IARC) potentially toxic compound. Following oral exposure, the treatment is symptomatic and supportive and includes monitoring for the development of hypersensitivity reactions with respiratory distress. Provide adequate airway management when needed. Gastric decontamination is usually not required unless the pyrethrin product is combined with a hydrocarbon. Following inhalation exposure, move patient to fresh air. monitor for respiratory distress. If cough or difficulty breathing develops, evaluate for respiratory tract irritation, bronchitis, or pneumonitis. Administer oxygen and assist ventilation as required. Treat bronchospasm with inhaled beta2 agonist and oral or parenteral corticosteroids. In case of eye exposure, irrigate exposed eyes with copious amounts of room temperature water for at least 15 minutes. If irritation, pain, swelling, lacrimation, or photophobia persist, the patient should be seen in a health care facility. If the contamination occurs through dermal exposure, Remove contaminated clothing and wash exposed area thoroughly with soap and water. A physician may need to examine the area if irritation or pain persists. Vitamin E topical application is highly effective in relieving parenthesis (L363) (T3DB). P - Antiparasitic products, insecticides and repellents > P03 - Ectoparasiticides, incl. scabicides, insecticides and repellents > P03A - Ectoparasiticides, incl. scabicides > P03AC - Pyrethrines, incl. synthetic compounds D010575 - Pesticides > D007306 - Insecticides > D011722 - Pyrethrins D016573 - Agrochemicals
alatolide
A germacrane sesquiterpenoid laactone obtained by formal condensation of the carboxy group of isobutyric acid with the secondary hydroxy group of trihydroxygermaeranolide.
Arctiopicrin
Arctiopicrin belongs to germacranolides and derivatives class of compounds. Those are sesquiterpene lactones with a structure based on the germacranolide skeleton, characterized by a gamma lactone fused to a 1,7-dimethylcyclodec-1-ene moiety. Arctiopicrin is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Arctiopicrin can be found in burdock, which makes arctiopicrin a potential biomarker for the consumption of this food product.
Millefin
Millefin is found in herbs and spices. Millefin is a constituent of Achillea millefolium (yarrow). Constituent of Achillea millefolium (yarrow). Millefin is found in herbs and spices.
Calonectrin
Mycotoxin. of Calonectria nivalis Mycotoxin. of Calonectria nivali
Romergoline
5-((2-(Diethylamino)ethyl)amino)-8-hydroxy-6H-imidazo[4,5,1-de]acridin-6-one
Carthamoside A1
Carthamoside a1 is a member of the class of compounds known as fatty acyl glycosides of mono- and disaccharides. Fatty acyl glycosides of mono- and disaccharides are compounds composed of a mono- or disaccharide moiety linked to one hydroxyl group of a fatty alcohol or of a phosphorylated alcohol (phosphoprenols), a hydroxy fatty acid or to one carboxyl group of a fatty acid (ester linkage) or to an amino alcohol. Carthamoside a1 is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Carthamoside a1 can be found in safflower, which makes carthamoside a1 a potential biomarker for the consumption of this food product.
2-Methyl-4-methoxy-5-methyl-2-[2-[(2-methyl-1-oxopropoxy)methyl]oxiranyl]phenyl ester
1.Xi.,5.xi.,7.xi.,10.xi.-Ambros-11(13)-en-12-oic acid, 1,6,14-trihydroxy-4-oxo-, .gamma.-lactone,14-isobutyrate
ent-15,16-Epoxy-2beta,3beta,19-trihydroxy-18-nor-13(16),14-labdadiene-7,12-dione
(E,E)-5-[4-(Acetyloxy)-2-methyl-2-butenyl]-3-[5-(acetyloxy)-4-methyl-3-pentenyl]-2(5H)-furanone
5beta-angeloyloxy-3a,4,5,6,7,7a-hexahydro-3abeta-methyl-1H-indene-2,4beta-dioic acid dimethyl ester
O3-Me,O1-(3-methyl-2-butenyl),di-Ac-3,5-Dihydroxy-4-methyl-1,2-benzenedimethanol
4-hydroxy-3-[(1R,6R)-3-methyl-6-(1-methylethyl)cyclohex-2-en-1-yl]-6-[(1E)-2-phenylethenyl]-2H-pyran-2-one|katsumadain
9beta-hydroxy-8beta-isobutyryloxy-1beta,10alpha-epoxycostunolide
18-acetoxy nor fluorocurarine|18-Acetoxynorfluorocurarine
9alpha-isobutyryloxy-4beta,5alpha-epoxydesacetyl laurenobiolide
1beta,10alpha-dihydroxy-6beta-[(2-methylpropyl)oxy]furanoeremophil-9-one|rel-(4S,4aS,5S,8R,8aR)-4,4a,5,6,7,8,8a-octahydro-8,8a-dihydroxy-3,4a,5-trimethyl-9-oxonaphtho[2,3-b]furan-4-yl 2-methylpropanoate
(-)-(1S,2R,3S,6R,9S,10R)-2alpha,3alpha-diacetoxy-9alpha-hydroxyamorpha-4,7(11)-dien-8-one
3beta,8alpha-dihydroxy-6beta-isobutyryloxyeremophil-1(10),7(11)-dien-12,8beta-olide
9beta,15-diacetoxygermacra-1(10),4-dien-11beta,13-dihydro-6alpha,12-olide
14-hydroxy-8beta-isobutyryloxy-1beta,10alpha-epoxycostunolide
1alpha,3beta-diacetoxyeudesm-4-en-6beta,11betaH-12,6-olide
3beta,8alpha-dihydroxyguaia-4(15),10(14)-dien-1alpha,5alpha,6beta,11betaH,12,6-olide 8-O-<2(S)-3-hydroxy-2-methylpropionate>
12-Hydroxystrychnine|4-hydroxy-strychnidin-10-one|4-Hydroxy-strychnin|4-hydroxy-strychnine|4-Hydroxystrychnin|4-Hydroxystrychnine
2beta-ethoxy-2,3-dihydrohelenalin-6-O-acetate|2beta-ethoxy-6-O-acetyl-2,3-dihydrohelenalin
8-(2-Methylpropanoyl)-(1(10)E,4beta,5alpha,6beta,7alpha,8alpha)-form-4,5-Epoxy-7,8-dihydroxy-1(10),11(13)-germacradien-12,6-olide
2beta,4a,8xi-Trihydroxy-1beta,8xi-dimethyl-4aalpha,7beta-gibban-1alpha,10beta-dicarbonsaeure-1=>4a-lacton|2beta,4a,8xi-trihydroxy-1beta,8xi-dimethyl-4aalpha,7beta-gibbane-1alpha,10beta-dicarboxylic acid-1=>4a lactone|Gibberellin A(2)|Gibberellin-A(2)
2-Methylbutyric acid [3-[3-methoxy-4-(isobutyryloxy)phenyl]oxiranyl]methyl ester
10alpha-hydroxy-9alpha-isobutyryloxy-1alpha,4alpha-endoperoxyguaia-2,11(13)-dien-12,6alpha-olide
(1R,4S)-1,5-cyclo-5alpha-hydroxy-8alpha-isobutyryloxy-7alpha,10alpha-oxagermacran-12,6beta-olide
(1aR,4S,4aS,5S,5aS,6S,8aS,9aS)-octahydro-4,4a,6-trimethyl-7-oxo-5a,8a-epoxyoxireno[8,8a]naphtho[2,3-b]furan-5(9H)-yl 2-methylpropanoate|11alphaH-6beta-isobutyryloxy-1beta,10beta,7beta,8beta-diepoxyeremophilan-12,8alpha-olide
(-)-12,15-diacetoxy-6beta-hydroxy-1beta,7alpha,10beta-H-guaia-4,11(13)-dien-3-one
(-)-6beta,12-diacetoxy-15-hydroxy-1beta,7alpha,10beta-H-guaia-4,11(13)-dien-3-one
(-)-6beta,15-diacetoxy-12-hydroxy-1beta,7alpha,10beta-H-guaia-4,11(13)-dien-3-one
4beta,15beta-dihydroxy-2a-isobutyryloxyguaiac-10(14),11(13)-dien-8beta,12-olide|minimolide G
(4S,4aS,5S,8R,8aS)-4,4a,5,6,7,8,8a,9-octahydro-8,8a-dihydroxy-3,4a,5-trimethylnaphtho[2,3-b]furan-4-yl 2-(hydroxymethyl)prop-2-enoate
Spiro[furan-3(2H),2-[2H]inden]-2-one, 1,7-bis(acetyloxy)decahydro-3a,4-dimethyl-4-methylene-, [1R-(1.alpha.,2.alpha.,3a.alpha.,4.alpha.,7.beta.,7a.alpha.)]-
15-hdyroxy-8alpha-(3-hydroxy-isobutanoyloxy)-elemane-1,3,11(13)-trien-12,6-olide
15-hydroxy-strychnidin-10-one|15-hydroxy-strychnine|15-Hydroxystrychnin|15-Hydroxystrychnine
5-Hydroxy-2-(8-phenyloctyl)-4H-1-benzopran-4-one|castanone
9-(2-Methylpropanoyl)-(1(10)E,4beta,5alpha,6alpha,8alpha,9alpha)-4,5-Epoxy-8,9-dihydroxy-1(10),11(13)-germacradien-12,6-olide
4alpha-[2-hydroxymethylacryloxy]-1beta-hydroxy-14-(5->6)abeoeremophilan-12,8-olide
16,19-Seco-strychnidin-10,16-dion|16,19-seco-strychnidine-10,16-dione|icajine|Pseudostrychnin
11beta,13-Dihydro-8alpha-hydroxy-1alpha-<2-(hydroxymethyl)acryloyloxy>cyclocostunolid|11beta,13-Dihydro-8alpha-hydroxy-1alpha-[2-(hydroxymethyl)acryloyloxy]cyclocostunolid
1-acetyl-17,18-epoxy-cura-2(16),19-dien-17-ol|2,16-Dehydrodiabolin
9alpha,14-dihydroxy-15-isobutyryloxy-costunolide|9alpha,14-dihydroxy-15-isobutyryloxycostunolide
(3E,6alpha,8beta)-6,14,15-trihydroxy-8-(2-methylacryloxy)germacra-3,11(13)-dieno-12,6-lactone|8alpha-methylacryloxy-14,15-dihydroxy-3(4),11(13)-germacradien-6,12-olide
benzastatin C
A quinoline alkaloid that is 1,2,3,4-tetrahydroquinoline-6-carboxamide substituted by a chloro group at position 3 and a 3,4-dimethylpent-3-en-1-yl and a methoxymethyl group at position 2 (the 2R,3R stereoisomer). Isolated from the culture broth of Streptomyces nitrosporeus 30643, it exhibits inhibitory potential against lipid peroxidation and anti-HSV activity.
(+)-12,13-epoxy-3alpha,8alpha-dihydroxytrichothec-9-en-4beta-yloxy isocrotonate|trichothecinol C
2-oxo-10alpha-peroxi-8beta-isobutyryloxyguaia-3,11(13)-dien-12,6alpha-olide
10-hydroxystrychnine|2-hydroxy-strychnidin-10-one|2-Hydroxy-strychnin|2-hydroxy-strychnine
1-[6-[(3,7-dimethyl-2,6-octadienyl)oxy]-2,4-dihydroxy-3-methoxyphenyl]-2-hydroxyethanone
8-(2-Methylpropanoyl)-(1alpha,4beta,5beta,6beta,7alpha,8alpha,10alpha)-form-7,10-Epoxy-4,8-dihydroxy-11-guaien-12,6-olide
16, 17-dihydro-16alpha, 17-dihydroxy gibberellin A9
Vallesiachotamine
Anticancer agent 96
Scandine
CID 12082288 is a natural product found in Melodinus fusiformis with data available.
[(10Z)-6,10-bis(hydroxymethyl)-3-methylidene-2-oxo-3a,4,5,6,7,8,9,11a-octahydrocyclodeca[b]furan-4-yl] 2-methylprop-2-enoate
phenothrin
P - Antiparasitic products, insecticides and repellents > P03 - Ectoparasiticides, incl. scabicides, insecticides and repellents > P03A - Ectoparasiticides, incl. scabicides > P03AC - Pyrethrines, incl. synthetic compounds D010575 - Pesticides > D007306 - Insecticides > D011722 - Pyrethrins D016573 - Agrochemicals CONFIDENCE standard compound; INTERNAL_ID 672; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5809; ORIGINAL_PRECURSOR_SCAN_NO 5806 CONFIDENCE standard compound; INTERNAL_ID 672; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5831; ORIGINAL_PRECURSOR_SCAN_NO 5829 CONFIDENCE standard compound; INTERNAL_ID 672; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5837; ORIGINAL_PRECURSOR_SCAN_NO 5834 CONFIDENCE standard compound; INTERNAL_ID 672; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5839; ORIGINAL_PRECURSOR_SCAN_NO 5837 CONFIDENCE standard compound; INTERNAL_ID 672; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 10868; ORIGINAL_PRECURSOR_SCAN_NO 10863 CONFIDENCE standard compound; INTERNAL_ID 672; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 10984; ORIGINAL_PRECURSOR_SCAN_NO 10980
[(10Z)-6,10-bis(hydroxymethyl)-3-methylidene-2-oxo-3a,4,5,6,7,8,9,11a-octahydrocyclodeca[b]furan-4-yl] 2-methylprop-2-enoate_major
[(10Z)-6,10-bis(hydroxymethyl)-3-methylidene-2-oxo-3a,4,5,6,7,8,9,11a-octahydrocyclodeca[b]furan-4-yl] 2-methylprop-2-enoate_29.0\\%
Calonectrin
(3S,4R)-1-BOC-3-HYDROXYMETHYL-4-(4-FLUOROPHENYL)-PIPERIDINE
BENZYL 3-((TERT-BUTOXYCARBONYLAMINO)METHYL)-4-HYDROXYPYRROLIDINE-1-CARBOXYLATE
6-METHOXY-1,2,3,4-TETRAHYDRO-NAPHTHALEN-2-YLAMINEHYDROCHLORIDE
(3R,4R)-3-(Boc-amino)-1-Cbz-4-(hydroxymethyl)pyrrolidine
methyl 4-fluoro-1-[tris(propan-2-yl)silyl]-1H-pyrrolo[2,3-b]pyridine-5-carboxylate
2-(4-BOC-PIPERAZINYL)-2-(3-METHOXY-PHENYL)ACETIC ACID
tert-butyl (3R)-3-{[(benzyloxy)carbonyl]amino}-4-(hydroxyMethyl)
BENZYL (3R,4R)-3-(TERT-BUTOXYCARBONYLAMINO)-4-HYDROXYPIPERIDINE-1-CARBOXYLATE
3-O-Benzyl-1,2:5,6-di-O-isopropylidene-alpha-D-allofuranose
BENZYL (3R,4R)-4-(TERT-BUTOXYCARBONYLAMINO)-3-HYDROXYPIPERIDINE-1-CARBOXYLATE
1H-Indole,1-[(2-ethyl-2,3-dihydro-6-methyl-3-oxo-4H-1,4-benzoxazin-4-yl)acetyl]-2,3-dihydro-(9CI)
(6a,11b,16a)-6,9-Difluoro-11-hydroxy-16-methylandrosta-1,4-diene-3,17-dione
2-(2-methoxyphenyl)-2-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]acetic acid
9-Amino-N-(2-(4-morpholinyl)ethyl)-4-acridinecarboxamide
(S)-1-[3-(Cyclopropyl-Methyl-aMino)-propyl]-1-(4-fluoro-phenyl)-1,3-dihydro-isobenzofuran-5-carbonitrile
1,8-Diazaspiro[5.5]undecane-8-carboxylic acid, 1-(2,2,2-trifluoroacetyl)-, 1,1-dimethylethyl ester
1,9-Diazaspiro[5.5]undecane-9-carboxylic acid, 1-(2,2,2-trifluoroacetyl)-, 1,1-dimethylethyl ester
1H-Indole,1-[(2-ethyl-2,3-dihydro-3-oxo-4H-1,4-benzoxazin-4-yl)acetyl]-2,3-dihydro-2-methyl-(9CI)
benzyl (3R,4R)-3-(hydroxymethyl)-4-[(2-methylpropan-2-yl)oxycarbonylamino]pyrrolidine-1-carboxylate
4-(2-TERT-BUTOXYCARBONYLAMINO-3-PHENYL-PROPIONYLAMINO)-BUTYRIC ACID
D-Phenothrin
D010575 - Pesticides > D007306 - Insecticides > D011722 - Pyrethrins D016573 - Agrochemicals
3-O-Benzyl-1,2,5,6-di-O-isopropylidene-alpha-D-glucofuranose
1-O-benzyl 4-O-tert-butyl (2R)-2-(hydroxymethyl)piperazine-1,4-dicarboxylate
3-Pyridinecarboxylic acid, 1-(2-(((diphenylmethylene)amino)oxy)ethyl)-1,2,5,6-tetrahydro-
D018377 - Neurotransmitter Agents > D018682 - GABA Agents > D018756 - GABA Antagonists D018377 - Neurotransmitter Agents > D014179 - Neurotransmitter Uptake Inhibitors D002491 - Central Nervous System Agents > D000927 - Anticonvulsants D049990 - Membrane Transport Modulators
Methanone, (1-amino-5-ethyl-8,9-dihydro-8,8-dimethyl-6H-furo(2,3-b)pyrano(4,3-d)pyridin-2-yl)phenyl-
Trichothec-9-ene-3,15-diol, 12,13-epoxy-, 15-acetate, (3alpha)-
N-(3,4-dimethylphenyl)-2-(4-methylanilino)-6-oxo-4,5-dihydro-1H-pyrimidine-4-carboxamide
1-[4-Carboxy-2-(3-pentylamino)phenyl]-5,5-DI(hydroxymethyl)pyrrolidin-2-one
[5-(3,4,5-Trihydroxy-6-hydroxymethyl-tetrahydro-pyran-2-ylcarbamoyl)-pentyl]-carbamic acid methyl ester
[(10S,12S,13E,14R,16S,18R)-13-ethylidene-14-hydroxy-8,15-diazahexacyclo[14.2.1.01,9.02,7.010,15.012,17]nonadeca-2,4,6,8-tetraen-18-yl] acetate
methyl (15alpha,16R,19E)-17-oxosarpagan-16-carboxylate
[(1R,2R,10R)-10-acetyloxy-1,5-dimethylspiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2-oxirane]-2-yl]methyl acetate
[(10S,12S,13R,14S,16S,18R)-13-formyl-14-methyl-8,15-diazahexacyclo[14.2.1.01,9.02,7.010,15.012,17]nonadeca-2,4,6,8-tetraen-18-yl] acetate
methyl (1R,10S,11S,12E,17S)-12-ethylidene-10-formyl-8,14-diazapentacyclo[9.5.2.01,9.02,7.014,17]octadeca-2,4,6,8-tetraene-10-carboxylate
(1R,2R,5R,6R,8R,9S,10R,11S)-6-hydroxy-6-(hydroxymethyl)-11-methyl-16-oxo-15-oxapentacyclo[9.3.2.15,8.01,10.02,8]heptadecane-9-carboxylic acid
methyl (15E)-15-ethylidene-13-formyl-3,17-diazapentacyclo[12.3.1.02,10.04,9.012,17]octadeca-2(10),4,6,8-tetraene-13-carboxylate
(2R,5R,6R,8R,9S,10R,11S)-6-hydroxy-6-(hydroxymethyl)-11-methyl-16-oxo-15-oxapentacyclo[9.3.2.15,8.01,10.02,8]heptadecane-9-carboxylic acid
N-[3-(2-methoxyphenyl)-1-methyl-4-oxo-2-quinolinyl]-2-methylpropanamide
N-(2,4-dimethoxyphenyl)-2-(1-pyrrolidinyl)-4-quinazolinamine
2-[(5-Methyl-1,3-benzoxazol-2-yl)amino]-5-spiro[1,6,7,8-tetrahydroquinazoline-4,1-cyclopentane]one
[(1R,2S,5R,6R,9R,10R,11S,12R)-2,6-dihydroxy-7,10,11-trimethyl-4,14-dioxatetracyclo[7.4.1.02,11.05,10]tetradec-7-en-12-yl] (Z)-but-2-enoate
6-[4-[2-(4-morpholinyl)ethylamino]-1H-quinazolin-2-ylidene]-1-cyclohexa-2,4-dienone
N-[(2S)-1-(1H-benzimidazol-2-ylamino)-3-methyl-1-oxobutan-2-yl]-3-methylbenzamide
N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-N-(2-methylphenyl)propanamide
N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-N-(2-phenylethyl)acetamide
2-methoxy-6-[4-(4-methyl-1-piperazinyl)-1H-quinazolin-2-ylidene]-1-cyclohexa-2,4-dienone
N-butyl-4-[(Z)-(4-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ylidene)methyl]benzamide
Isostrychnine N-oxide
A monoterpenoid indole alkaloid with formula C21H22N2O3, originally isolated from the seeds of Strychnos nux-vomica.
2-[(6-Methyl-1,3-benzoxazol-2-yl)amino]-5-spiro[1,6,7,8-tetrahydroquinazoline-4,1-cyclopentane]one
N-[(2S,3R,6R)-6-[2-[(2-fluorophenyl)methylamino]-2-oxoethyl]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-3-yl]propanamide
2-[(2S,5S,6R)-5-acetamido-6-(hydroxymethyl)-2-oxanyl]-N-[(3-methoxyphenyl)methyl]acetamide
2-[(2R,5S,6S)-5-acetamido-6-(hydroxymethyl)oxan-2-yl]-N-[(3-methoxyphenyl)methyl]acetamide
2-[(2S,5R,6S)-5-acetamido-6-(hydroxymethyl)-2-oxanyl]-N-[(3-methoxyphenyl)methyl]acetamide
2-[(2R,5R,6S)-5-acetamido-6-(hydroxymethyl)oxan-2-yl]-N-[(3-methoxyphenyl)methyl]acetamide
2-[(2S,5S,6S)-5-acetamido-6-(hydroxymethyl)-2-oxanyl]-N-[(3-methoxyphenyl)methyl]acetamide
N-[(2R,3S,6S)-6-[2-[(2-fluorophenyl)methylamino]-2-oxoethyl]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-3-yl]propanamide
N-[(2R,3S,6R)-6-[2-[(2-fluorophenyl)methylamino]-2-oxoethyl]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-3-yl]propanamide
N-[(2R,3R,6R)-6-[2-[(2-fluorophenyl)methylamino]-2-oxoethyl]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-3-yl]propanamide
[(3aS,4R,9bS)-4-(hydroxymethyl)-8-[(E)-prop-1-enyl]-2,3,3a,4,5,9b-hexahydropyrrolo[3,2-c]quinolin-1-yl]-pyrazin-2-ylmethanone
2-[(2R,5S,6R)-5-acetamido-6-(hydroxymethyl)-2-oxanyl]-N-[(3-methoxyphenyl)methyl]acetamide
2-[(2R,5R,6R)-5-acetamido-6-(hydroxymethyl)-2-oxanyl]-N-[(3-methoxyphenyl)methyl]acetamide
2-[(2S,5R,6R)-5-acetamido-6-(hydroxymethyl)-2-oxanyl]-N-[(3-methoxyphenyl)methyl]acetamide
N-[(2S,3R,6S)-6-[2-[(2-fluorophenyl)methylamino]-2-oxoethyl]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-3-yl]propanamide
N-[(2S,3S,6R)-6-[2-[(2-fluorophenyl)methylamino]-2-oxoethyl]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-3-yl]propanamide
N-[(2R,3R,6S)-6-[2-[(2-fluorophenyl)methylamino]-2-oxoethyl]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-3-yl]propanamide
N-[(2S,3S,6S)-6-[2-[(2-fluorophenyl)methylamino]-2-oxoethyl]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-3-yl]propanamide
9-Chloro-17beta-hydroxy-17-methylandrost-4-ene-3,11-dione
(4aR,5aR,8aS,13aS,15bR)-5a-hydroxy-2,4a,5,7,8,13a,15,15a,15b,16-decahydro4,6-methanoindolo[3,2,1-ij]oxepino[2,3,4-de]pyrrolo[2,3-h]quinolin-14-one
Trichothecene analogue
A natural product found in Trichothecium speciesMSX 51320.
3,17-dihydroxy-5,9-dioxo-4,5-9,10-diseco-androsta-1(10),2-dien-4-oic acid
ABT-046
ABT-046 is a potent, selective, and orally active acyl CoA:diacylglycerol acyltransferase 1 (DGAT-1) inhibitor with IC50s of both 8 nM against human and mouse DGAT-1[1].
(1r,9r,12s)-6,9,12-trihydroxy-5-isopropyl-1,10,10-trimethyl-8-oxatricyclo[7.4.0.0²,⁷]trideca-2,4,6-triene-3-carboxylic acid
(1r,2s,5r,8r,9r,10r,11s,12s,13s,16s)-8,9,12-trihydroxy-2,10,16-trimethyl-6-methylidene-14-oxatetracyclo[11.2.1.0²,¹¹.0⁵,¹⁰]hexadecane-3,15-dione
{6a-hydroxy-9a-methyl-3-methylidene-2,9-dioxo-hexahydro-3ah-azuleno[4,5-b]furan-6-yl}methyl 2-methylpropanoate
9b-hydroxy-6,6,9a-trimethyl-1-oxo-3h,5h,5ah,7h,8h,9h-naphtho[1,2-c]furan-5-yl 4-hydroxybut-2-enoate
(1s,2r,6r,8s,9s,10r,12r,13r,16r)-8,9,12-trihydroxy-2,6,10,16-tetramethyl-14-oxatetracyclo[11.2.1.0²,¹¹.0⁵,¹⁰]hexadec-4-ene-3,15-dione
(2e)-4-{3-[(1e)-hept-1-en-1-yl]-5-hydroxy-4-(hydroxymethyl)-2-oxo-7-oxabicyclo[4.1.0]hept-3-en-1-yl}-2-methylbut-2-enoic acid
10-(hydroxymethyl)-6-methyl-3-methylidene-2-oxo-3ah,4h,5h,8h,9h,11ah-cyclodeca[b]furan-4-yl 3-hydroxy-2-methylpropanoate
(2s)-2-[(4r,5s)-5-[3-(acetyloxy)prop-1-en-2-yl]-4-ethenyl-4-methyl-3-oxocyclohex-1-en-1-yl]-2-hydroxypropyl acetate
methyl (1s,12s,13r,14r,15e)-15-ethylidene-13-formyl-3,17-diazapentacyclo[12.3.1.0²,¹⁰.0⁴,⁹.0¹²,¹⁷]octadeca-2(10),4,6,8-tetraene-13-carboxylate
methyl (1s,12s,14r,15e)-15-ethylidene-13-formyl-3,17-diazapentacyclo[12.3.1.0²,¹⁰.0⁴,⁹.0¹²,¹⁷]octadeca-2(10),4,6,8-tetraene-13-carboxylate
(3ar,4s)-10-(hydroxymethyl)-6-methyl-3-methylidene-2-oxo-3ah,4h,5h,8h,9h,11ah-cyclodeca[b]furan-4-yl 3-hydroxy-2-methylpropanoate
6-butoxy-9,11-dihydroxy-10-methoxy-4-methyl-1,4,5,6-tetrahydro-3-benzoxecin-2-one
(1r,9s,10r,11r,17s)-8,12-diacetyl-8,14-diazapentacyclo[9.5.2.0¹,⁹.0²,⁷.0¹⁴,¹⁷]octadeca-2,4,6,12-tetraene-10-carbaldehyde
(4s,4ar,5r,6s,9ar)-6,9a-dihydroxy-3,4a,5-trimethyl-2-oxo-4h,5h,6h,7h,9h-naphtho[2,3-b]furan-4-yl 2-methylpropanoate
(3s,3ar,4s,9r,11ar)-4-(acetyloxy)-3,6,10-trimethyl-2-oxo-3h,3ah,4h,5h,8h,9h,11ah-cyclodeca[b]furan-9-yl acetate
(3ar,4as,5s,7s,7as,8r,9as)-5-(acetyloxy)-4a,8-dimethyl-3-methylidene-2-oxo-octahydro-3ah-azuleno[6,5-b]furan-7-yl acetate
[(3as,5r,11ar)-5-hydroxy-6-(hydroxymethyl)-3-methylidene-2-oxo-3ah,4h,5h,8h,9h,11ah-cyclodeca[b]furan-10-yl]methyl 2-methylpropanoate
8,8a-dihydroxy-3,4a,5-trimethyl-4h,5h,6h,7h,8h,9h-naphtho[2,3-b]furan-4-yl 2-(hydroxymethyl)prop-2-enoate
(1s,2s,3s,4r,8r,9r,10r,11r)-3-hydroxy-2,11-dimethyl-7-methylidene-6-oxo-5,14-dioxatetracyclo[9.2.1.0²,¹⁰.0⁴,⁸]tetradecan-9-yl 2-methylpropanoate
{9a-hydroxy-6a-methyl-3-methylidene-2,9-dioxo-hexahydro-3ah-azuleno[4,5-b]furan-6-yl}methyl 2-methylpropanoate
13-hydroxy-13-isopropyl-3,7,12-trimethyl-10,14,16-trioxatetracyclo[7.5.1.1³,⁶.0¹²,¹⁵]hexadec-5-ene-4,11-dione
4-hydroxy-3-[(1r,6r)-6-isopropyl-3-methylcyclohex-2-en-1-yl]-6-[(1e)-2-phenylethenyl]pyran-2-one
6-hydroxy-12-oxa-8,17-diazaheptacyclo[15.5.2.0¹,¹⁸.0²,⁷.0⁸,²².0¹¹,²¹.0¹⁵,²⁰]tetracosa-2,4,6,14-tetraen-9-one
[5-hydroxy-6-(hydroxymethyl)-3-methylidene-2-oxo-3ah,4h,5h,8h,9h,11ah-cyclodeca[b]furan-10-yl]methyl 2-methylpropanoate
13-hydroxy-12-methyl-11-oxo-10,14-dioxapentacyclo[11.2.2.1¹,⁹.0²,⁷.0¹²,¹⁸]octadecan-6-yl acetate
(4s,6r)-6-butoxy-9,11-dihydroxy-10-methoxy-4-methyl-1,4,5,6-tetrahydro-3-benzoxecin-2-one
6-hydroxy-6,10-dimethyl-3-methylidene-2,9-dioxo-3ah,4h,5h,10h,11h,11ah-cyclodeca[b]furan-4-yl 2-methylpropanoate
(1'r,2s,2's,4's,8'r,9'r)-9'-(acetyloxy)-3',3'-dimethyl-10'-oxaspiro[oxirane-2,7'-tricyclo[6.4.0.0²,⁴]dodecan]-11'-en-12'-ylmethyl acetate
4-[3-(hept-1-en-1-yl)-5-hydroxy-4-(hydroxymethyl)-2-oxo-7-oxabicyclo[4.1.0]hept-3-en-1-yl]-2-methylbut-2-enoic acid
(3ar,4r,6r,6ar,9ar,9br)-6-hydroperoxy-6,9-dimethyl-3-methylidene-4-(2-methylpropoxy)-3ah,4h,5h,6ah,9ah,9bh-azuleno[4,5-b]furan-2,7-dione
methyl (13z)-13-ethylidene-18-formyl-8,15-diazapentacyclo[10.5.1.0¹,⁹.0²,⁷.0¹⁰,¹⁵]octadeca-2,4,6,8-tetraene-18-carboxylate
methyl 2-[(3,7-dimethylocta-2,6-dien-1-yl)oxy]-4,6-dihydroxy-3-(hydroxymethyl)benzoate
(3ar,4s,6r,11as)-6,10-bis(hydroxymethyl)-3-methylidene-2-oxo-3ah,4h,5h,6h,7h,8h,9h,11ah-cyclodeca[b]furan-4-yl 2-methylprop-2-enoate
(1r,10s,12r,13r,14s,16s,17s,18r)-13-formyl-14-methyl-8,15-diazahexacyclo[14.2.1.0¹,⁹.0²,⁷.0¹⁰,¹⁵.0¹²,¹⁷]nonadeca-2,4,6,8-tetraen-18-yl acetate
[9-(acetyloxy)-6-methyl-3-methylidene-2-oxo-octahydro-3ah-azuleno[4,5-b]furan-9a-yl]methyl acetate
2-[(4r,5s,8r,8ar)-4-(acetyloxy)-3-(hydroxymethyl)-8-methyl-2-oxo-4,5,6,7,8,8a-hexahydro-1h-azulen-5-yl]prop-2-en-1-yl acetate
methyl (2r,12bs)-2-[(2z)-1-oxobut-2-en-2-yl]-1h,2h,6h,7h,12h,12bh-indolo[2,3-a]quinolizine-3-carboxylate
4-(acetyloxy)-7,7a-dimethyl-4'-methylidene-2'-oxo-hexahydro-1h-spiro[indene-2,3'-oxolan]-3-yl acetate
4-[(3ar,7s,8ar)-7-methyl-3-methylidene-2-oxo-3ah,4h,7h,8h,8ah-cyclohepta[b]furan-6-yl]-4-(acetyloxy)butan-2-yl acetate
(1's,2s,2'r,4's,7'r,9'r,10'r,11's)-4',10'-dihydroxy-1',2',5'-trimethyl-8'-oxaspiro[oxirane-2,12'-tricyclo[7.2.1.0²,⁷]dodecan]-5'-en-11'-yl (2z)-but-2-enoate
8,12-diacetyl-8,14-diazapentacyclo[9.5.2.0¹,⁹.0²,⁷.0¹⁴,¹⁷]octadeca-2,4,6,12-tetraene-10-carbaldehyde
(1s,2z,4r,8r,9r,11r)-1-hydroxy-2,11-dimethyl-7-methylidene-6-oxo-5,14-dioxatricyclo[9.2.1.0⁴,⁸]tetradec-2-en-9-yl 2-methylpropanoate
(3as,4s,7ar)-6-(hydroxymethyl)-5-[(2s)-5-hydroxypentan-2-yl]-3-methylidene-2-oxo-3a,4,7,7a-tetrahydro-1-benzofuran-4-yl 2-methylprop-2-enoate
6-dehydroxylongilactone
{"Ingredient_id": "HBIN012304","Ingredient_name": "6-dehydroxylongilactone","Alias": "NA","Ingredient_formula": "C19H26O6","Ingredient_Smile": "CC1C(C(C2C3(C(CC4C2(C1C(=O)O4)C)C(=CC(=O)C3O)C)C)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "4985","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}