Exact Mass: 334.1681192
Exact Mass Matches: 334.1681192
Found 500 metabolites which its exact mass value is equals to given mass value 334.1681192,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Strychnine
Strychnine (/ˈstrɪkniːn, -nɪn/, STRIK-neen, -nin, US chiefly /-naɪn/ -nyne)[6][7] is a highly toxic, colorless, bitter, crystalline alkaloid used as a pesticide, particularly for killing small vertebrates such as birds and rodents. Strychnine, when inhaled, swallowed, or absorbed through the eyes or mouth, causes poisoning which results in muscular convulsions and eventually death through asphyxia.[8] While it is no longer used medicinally, it was used historically in small doses to strengthen muscle contractions, such as a heart and bowel stimulant[9] and performance-enhancing drug. The most common source is from the seeds of the Strychnos nux-vomica tree. Strychnine is a natural product found in Strychnos ignatii, Strychnos wallichiana D002491 - Central Nervous System Agents > D000697 - Central Nervous System Stimulants > D003292 - Convulsants A monoterpenoid indole alkaloid that is strychnidine bearing a keto substituent at the 10-position. D018377 - Neurotransmitter Agents > D018684 - Glycine Agents D009676 - Noxae > D011042 - Poisons Annotation level-1 relative retention time with respect to 9-anthracene Carboxylic Acid is 0.465 relative retention time with respect to 9-anthracene Carboxylic Acid is 0.456 CONFIDENCE standard compound; INTERNAL_ID 694; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5745; ORIGINAL_PRECURSOR_SCAN_NO 5743 CONFIDENCE standard compound; INTERNAL_ID 694; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5769; ORIGINAL_PRECURSOR_SCAN_NO 5767 CONFIDENCE standard compound; INTERNAL_ID 694; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5764; ORIGINAL_PRECURSOR_SCAN_NO 5762 CONFIDENCE standard compound; INTERNAL_ID 694; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5713; ORIGINAL_PRECURSOR_SCAN_NO 5712 CONFIDENCE standard compound; INTERNAL_ID 694; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5746; ORIGINAL_PRECURSOR_SCAN_NO 5745 CONFIDENCE standard compound; INTERNAL_ID 694; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5749; ORIGINAL_PRECURSOR_SCAN_NO 5746 CONFIDENCE Reference Standard (Level 1); INTERNAL_ID 2322
9-Fluoro-17-methyl-11-oxotestosterone
C20H27FO3 (334.19441240000003)
NCIOpen2_009201
C20H27FO3 (334.19441240000003)
NSC53899
C20H27FO3 (334.19441240000003)
9-Fluoro-16alpha-hydroxyandrost-4-ene-3,11,17-trione
Pseudaminic acid
1-(3,4-Dimethoxyphenyl)-2-(2-methoxyphenoxy)propane-1,3-diol
3-(2-Methylpropanoyloxy)-8-(2-methylbutanoyloxy)-9,10-epoxy-p-mentha-1,3,5-triene
3-(2-Methylpropanoyloxy)-8-(2-methylbutanoyloxy)-9,10-epoxy-p-mentha-1,3,5-triene is a member of phenols and a benzoate ester. (2-{4-Methyl-2-[(2-methylpropanoyl)oxy]phenyl}oxiran-2-yl)methyl 2-methylbutanoate is a natural product found in Arnica montana with data available. 3-(2-Methylpropanoyloxy)-8-(2-methylbutanoyloxy)-9,10-epoxy-p-mentha-1,3,5-triene is found in fats and oils. 3-(2-Methylpropanoyloxy)-8-(2-methylbutanoyloxy)-9,10-epoxy-p-mentha-1,3,5-triene is a constituent of various plant species including Madia sativa (Chile tarweed)
3-(2-Methylpropanoyloxy)-8-(3-methylbutanoyloxy)-9,10-epoxy-p-mentha-1,3,5-triene
3-(2-Methylpropanoyloxy)-8-(3-methylbutanoyloxy)-9,10-epoxy-p-mentha-1,3,5-triene is found in fats and oils. 3-(2-Methylpropanoyloxy)-8-(3-methylbutanoyloxy)-9,10-epoxy-p-mentha-1,3,5-triene is a constituent of Madia sativa (Chile tarweed) Constituent of Madia sativa (Chile tarweed). 3-(2-Methylpropanoyloxy)-8-(3-methylbutanoyloxy)-9,10-epoxy-p-mentha-1,3,5-triene is found in fats and oils.
4-Chloromethandienone
4-Chloromethandienone is a synthetic anabolic steroid, suspected of misuse in sports. Although the widespread use of androgenic anabolic steroids might be implicated in the development of hormone-sensitive tumors, there are few reports regarding a possible causal relation between doping and cancer; however, there is one reported case of a 32-year-old man that underwent right radical orchiectomy for a tumor (identified as an intratesticular leiomyosarcoma) of the upper pole of the right testicle where the patient reported a 5-year history of systematic use of high dose of 4-Chloromethandienone. (PMID: 10526287) [HMDB] 4-Chloromethandienone is a synthetic anabolic steroid, suspected of misuse in sports. Although the widespread use of androgenic anabolic steroids might be implicated in the development of hormone-sensitive tumors, there are few reports regarding a possible causal relation between doping and cancer; however, there is one reported case of a 32-year-old man that underwent right radical orchiectomy for a tumor (identified as an intratesticular leiomyosarcoma) of the upper pole of the right testicle where the patient reported a 5-year history of systematic use of high dose of 4-Chloromethandienone. (PMID: 10526287). D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones
Lipoyllysine
lipollysine is an important lipoic acid derivative. Most alpha-lipoic acid in food is derived from lipoamide-containing enzymes and is bound to the amino acid, lysine (lipoyllysine). Animal tissues that are rich in lipoyllysine include kidney, heart, and liver, while plant sources that are rich in lipoyllysine include spinach, broccoli, and tomatoes. Somewhat lower amounts of lipoyllysine have been measured in peas, brussel sprouts, and rice bran. Lipoic acid can be found in many common foods such as potatoes, carrots, broccoli, yeasts, beets, yams, and red meat. Dietary sources of ALA include flaxseeds, flaxseed oil, canola (rapeseed) oil, soybeans and soybean oil, pumpkin seeds and pumpkin seed oil, purslane, perilla seed oil, walnuts and walnut oil. The best food sources of lipoic acid are believed to be those foods rich in mitochondria - red meat (skeletal muscle, heart, liver, kidney). Other sources are yeast, spinach, and broccoli. Lypoyllysine is involved in Lipoate metabolism pathway where lipoyllysine is undergo hydrolysis to produce liporate and l-lysine. lipollysine is an important lipoic acid derivative. Most alpha-lipoic acid in food is derived from lipoamide-containing enzymes and is bound to the amino acid, lysine (lipoyllysine). Animal tissues that are rich in lipoyllysine include kidney, heart, and liver, while plant sources that are rich in lipoyllysine include spinach, broccoli, and tomatoes. Somewhat lower amounts of lipoyllysine have been measured in peas, brussel sprouts, and rice bran. Lipoic acid can be found in many common foods such as potatoes, carrots, broccoli, yeasts, beets, yams, and red meat. Dietary sources of ALA include flaxseeds, flaxseed oil, canola (rapeseed) oil, soybeans and soybean oil, pumpkin seeds and pumpkin seed oil, purslane, perilla seed oil, walnuts and walnut oil. The best food sources of lipoic acid are believed to be those foods rich in mitochondria - red meat (skeletal muscle, heart, liver, kidney). Other sources are yeast, spinach, and broccoli.
3,7-Dimethyl-5-octene-1,7-diol 1-glucoside
3,7-Dimethyl-5-octene-1,7-diol 1-glucoside is found in green vegetables. 3,7-Dimethyl-5-octene-1,7-diol 1-glucoside is a constituent of Rosa damascena (damask rose) Constituent of Rosa damascena (damask rose). 3,7-Dimethyl-5-octene-1,7-diol 1-glucoside is found in herbs and spices and green vegetables.
3'-N'-Acetylfusarochromanone
3-N-Acetylfusarochromanone is a mycotoxin produced by Fusarium equiseti. Mycotoxin production by Fusarium equiseti
1,5-Dibutyl methyl hydroxycitrate
1,5-Dibutyl methyl hydroxycitrate is found in fruits. 1,5-Dibutyl methyl hydroxycitrate is a constituent of the fruit of Garcinia atroviridis (gelugor). Constituent of the fruit of Garcinia atroviridis (gelugor). 1,5-Dibutyl methyl hydroxycitrate is found in fruits.
Amifloxacin
Amifloxacin belongs to the family of Phenylpiperazines. These are compounds containing a phenylpiperazine skeleton, which consists of a piperazine bound to a phenyl group. D000970 - Antineoplastic Agents > D059003 - Topoisomerase Inhibitors > D059005 - Topoisomerase II Inhibitors D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D024841 - Fluoroquinolones C254 - Anti-Infective Agent > C258 - Antibiotic > C795 - Quinolone Antibiotic D004791 - Enzyme Inhibitors
4-(4-Methylpiperazin-1-yl)-7-(trifluoromethyl)pyrrolo[1,2-a]quinoxaline
DL-Methionine-4-antipyrineamide
Strychnin
(E)-5-(1-(2-Hydroxyethyl)-3-(pyridin-4-yl)-1H-pyrazol-4-yl)-2,3-dihydro-1H-inden-1-one oxime
Pimobendan
D004791 - Enzyme Inhibitors > D010726 - Phosphodiesterase Inhibitors D002317 - Cardiovascular Agents > D014665 - Vasodilator Agents C471 - Enzyme Inhibitor > C744 - Phosphodiesterase Inhibitor D020011 - Protective Agents > D002316 - Cardiotonic Agents
Proglumide
C18H26N2O4 (334.18924760000004)
A - Alimentary tract and metabolism > A02 - Drugs for acid related disorders > A02B - Drugs for peptic ulcer and gastro-oesophageal reflux disease (gord) C78276 - Agent Affecting Digestive System or Metabolism > C29701 - Anti-ulcer Agent C78272 - Agent Affecting Nervous System > C28197 - Antianxiety Agent D005765 - Gastrointestinal Agents > D000897 - Anti-Ulcer Agents Proglumide is a nonpeptide and orally active cholecystokinin (CCK)-A/B receptors antagonist. Proglumide selective blocks CCK’s effects in the central nervous system (CNS). Proglumide has ability to inhibit gastric secretion and to protect the gastroduodenal mucosa. Proglumide also has antiepileptic and antioxidant activities[1][2][3][4][5].
S-Petasin
Tetroxoprim
1ST167749
Arnicolide C is a natural product found in Centipeda minima and Arnica montana with data available.
Arnicolide C
[1aR-(1aalpha,4alpha,4abeta,5beta,9aS*)]-1a,2,4,4a,5,9-Hexahydro-4-hydroxy-4,4a,6-trimethyl-3H-oxireno[8,8a]naphtho[2,3-b]furan-5-yl ester 2-methylpropanoic acid
2-Methyl-2-[2-[(acetyloxy)methyl]oxiranyl]-4-methoxy-5-methylphenyl ester
Gibberellin A10
A C19-gibberellin, initially identified in Gibberella fujikuroi. It differs from gibberellin A1 in the absence of the beta-OH at C-9 and the alpha-OH at C-7, the substitution of the methylene group at C-8 by a beta-Me and the presence of an alpha-OH also at C-8 (all gibbane skeletal numberings).
2-Methyl-4-(1,2-epoxy-1-methylethyl)-3-hydroxybenzyl ester isobutyrate
[4S-(4alpha,4aalpha,5beta,8aalpha)]-4,4a,5,6,7,8,8a,9-Octahydro-5-hydroxy-3,4a,5-trimethyl-9-oxonaphtho[2,3-b]furan-4-yl ester 2-methyl-propanoic acid
ent-15,16-Epoxy-2beta,3beta,19-trihydroxy-18-nor-8(17),13(16),14-labdatriene-12-dione
Combretastatin
D050258 - Mitosis Modulators > D050256 - Antimitotic Agents > D050257 - Tubulin Modulators D000970 - Antineoplastic Agents > D050256 - Antimitotic Agents
Subcordatolide C
13-(Dimethylarsinoyl)tridecanoic acid
C15H31AsO3 (334.1489035999999)
3beta-hydroxy-8alpha-isobutyryloxy-1-oxo-germacra-4E,10(14),11(13)-trien-12,6alpha-olide
4beta-Hydroxy-4,5-beta-dihydro-6-O-methacryloylsteiractinolid
3-(4-Hydroxy-3-methoxyphenyl)-2-(4-hydroxy-3,5-dimethoxyphenyl)-1-propanol
(?)-kopsifoline D|kopsifoline D|methyl (1R,4R,13R,20S)-6,16-diazahexacyclo[11.6.1.11.4.05.13.07.12.016.20]henicosa-5,7(12),8,10,18-pentaene-4-carboxylate
3beta-(2-methylbutyryloxy)-8-oxo-eremophila-6,9-dien-12-oic acid
1alpha-hydroxy-3alpha-isobutyryloxyisoalantolactone
(+)-17,19-didehydroapovincamine|17,18-didehydro-eburnamenine-14-carboxylic acid methyl ester
3-Ethoxy-1,3-dihydro-7-methoxy-6-methyl-5-<(3-methyl-2-butenyl)oxy>-1-oxo-4-isobenzofurancarbaldehyde
13-dimethylarsinoyl-tridecanoic acid
C15H31AsO3 (334.1489035999999)
(3S,5E,7R,8S,11E)-7,8,14,16-tetrahydroxy-3-methyl-3,4,7,8,9,10-hexahydro-1H-benzo[c][1]oxacyclotetradecin-1-one|Aigialomycin D
4-[(1E)-3-(acetyloxy)prop-1-en-1-yl]-2,6-dimethoxyphenyl (2Z)-2-methylbut-2-enoate|nervolan A
8alpha-Hydroxy-1alpha-(isobutyryloxy)cyclocostunolid
threo-2,3-bis-(4-hydroxy-3-methoxyphenyl)-3-methoxypropanol
Isostrychnine
A monoterpenoid indole alkaloid with formula C21H22N2O2, originally isolated from the seeds of Strychnos nux-vomica.
3-Methylbutyric acid 1-[3-methoxy-4-(isobutyryloxy)phenyl]-2-propenyl ester
(-)-12,13-epoxy-8alpha-hydroxytrichothec-9-en-4beta-yloxy isocrotonate|trichothecinol B
Desacylcynaropicrin-(epoxi-alpha-methacrylat)|Desacylcynaropicrin-
9-(2-Methylpropanoyl)-(1beta,6beta,9beta,10beta)-1,10-Epoxyfuranoeremophilane-6,9-diol
8alpha-isobutyryloxy-9alpha-hydroxy-montahibisciolide
(-)-(1R,2R,3S,6R,10S)-2alpha,3alpha-diacetoxyamorpha-4,7(11)-dien-8-one
10alpha-hydroxy-6beta-propionyloxy-1-oxoeremophila-7(11),8-dieno-12,8-lactone
2-(4-Hydroxy-3-methoxyphenyl)-3-(4-hydroxy-3,5-dimethoxyphenyl)-1-propanol
2-[(2S*,3S*)-6-O-acetyl-2,3-dihydro-3,5-dihydroxy-1-benzofuran-2-yl]prop-2-enyl 3-methylbutanoate
11beta,13-Dihydro-8alpha-hydroxy-1alpha-(2-methylacryloyloxy)cyclocostunolid
6beta-hydroxy-3beta-(2-methylacryloyl)oxy-11betaH-eremophil-7-en-12,8-olide|eremofarfugin B
10-isovaleryloxy-8,9-epoxy 7-northymol isovalerate
5alpha,6beta,14alpha-trihydroxyandrost-2-ene-1,17-dione|cinedione
chermesinone C
An azaphilone that is 9a,9b-dihydro-1H-furo[2,3-h]isochromene-6,8(6aH,9H)-dione substituted by a hydroxy group at position 1, methyl groups at positions 3 and 6a and a 2-methylbutanoyl group at position 9. It has been isolated from the culture of the mangrove endophytic fungus Penicillium chermesinum.
2,2-(1,1-methylenebis(1H-indole-3,1-diyl))diethanol
5alpha,11,12-trihydroxy-6-oxa-abieta-8,11,13-trien-7-one
(1R,2S)-1-(p-hydroxyphenyl)-2-(3-hydroxy-4-methoxyphenyl)-3-(2-hydroxyethanoxy)propanol|carayensin-A
1beta-O-Caprinoyl-D-glucopyranose|n-decanoyl beta-D-glucopyranoside
(+/-)-1-{6-hydroxy-2-(2-hydroxypropan-2-yl)-4-methoxy-7-[(1E)-3-methylbut-1-en-1-yl]-2,3-dihydro-1-benzofuran-5-yl}ethanone|pteleifolin A
4,5-epoxy-2alpha-isobutyryloxy-guaia-11(13)-en-8beta,12-olide|minimolide F
2,5-dimethyl-3-O-beta-D-glucopyranosylnaphthol|2,5-Dimethyl-3-O-??-D-glucopyranosylnaphthol
2-Methylpropanoic acid (4S)-4,4a,5,6,7,8,8abeta,9-octahydro-5alpha-hydroxy-3,4abeta,5-trimethyl-9-oxonaphtho[2,3-b]furan-4beta-yl ester
Methyl 15-acetoxygermacra-1(10)E,4Z,11(13)-trien-6alpha,12-olide-14-oic acid
3-oxo-10alpha-hydroxy-8beta-isobutyryloxyguaia-4,11(13)-dien-12,6alpha-olide
Strychnin
Origin: Plant; Formula(Parent): C21H22N2O2; Bottle Name:Strychnine nitrate; PRIME Parent Name:Strychnine; PRIME in-house No.:V0299; SubCategory_DNP: Alkaloids derived from tryptophan, beta-Carboline alkaloids, Indole alkaloids
(12beta)-12-hydroxyhuperzine G|2-{[(8aS,9S,11R,12aS)-3,4,6,7,8,8a,9,10,11,12-decahydro-8a-hydroxy-11-methyl-2H-9,1-ethanylylidenebenzo[i]quinolizin-14-yl]amino}-2-oxoacetic acid
C18H26N2O4 (334.18924760000004)
8beta-isobutyryloxy-1beta,10alpha-epoxycostunolide
1beta-acetoxy-8beta-ethoxy-eudesman-4(15),7(11)-dien-8alpha,12-olide
9beta-isobutyryloxy-1alpha,10beta-epoxyhaageanolide
ent-15beta-fluoro-7alpha-hydroxy-19-norkaur-16-ene-4beta,6beta-carbolactone
C20H27FO3 (334.19441240000003)
3-O-Alloside-Cerberidol-Cerberidol|cerberidol-3-O-beta-D-allopyranoside
5alpha-hydroxy-15-isobutyryloxy germacra-1(10)E,3Z,11(13)-trien-12,8alpha-olide
7,7,10-trimethyl-4-pentyl-7H-benzofuro<6,7-c><2>benzopyran|furo<1,2-a> 4-n-pentyl-7,7,10-trimethyl-dibenzopyran|furo[1,2-a] 4-n-pentyl-7,7,10-trimethyl-dibenzopyran
1-Phenanthrenecarboxylic acid, chloro-1,2,3,4,4a,9,10,10a-octahydro-1,4a-dimethyl-7-(1-methylethyl)-, (1R-(1.alpha.,4a.beta.,10a.alpha.))-
6,16,18-Trihydroxy-4-methyl-3-oxabicyclo[12.4.0]octadeca-1(14),12,15,17-tetraene-2,8-dione
9-(2-Methylpropanoyl)-(1(10)E,4E,6alpha,8alpha,9alpha)-6,9-Dihydroxy-1(10),4,11(13)-germacratrien-12,8-olide
8alpha-hydroxy-6beta-(isobutanoyloxy)-eremophila-7(11),1(10)-dieno-12,8beta-lactone
Isobutyric acid 2-methoxy-4-[1-(2-methylbutyryloxy)-2-propenyl]phenyl ester
17,19-Dihydroxy-2-oxa-13(16),14-spongiadien-3-one|2-oxa-17,19-dihydroxyspongia-13(16),14-dien-3-one
Ferulol-<2-(1-isobutyryloxyethyl)acrylat>|Ferulol-[2-(1-isobutyryloxyethyl)acrylat]
2-methyl-11-hydroxy-2,3,4,5,6,7,8-heptahydro-8-oxobenzoxonin-9-acetic acid ethyl ester|phomopsin B
4(O)-(3,3-Dimethylallyl)-syringaalkoholangelicat|4(O)-<3,3-Dimethylallyl>-syringaalkoholangelicat
proglumide
C18H26N2O4 (334.18924760000004)
A racemate composed of equal amounts of (R)- and (S)-proglumide. A non-selective CCK antagonist that was used primarily for treatment of stomach ulcers, but has been replaced by newer drugs. A - Alimentary tract and metabolism > A02 - Drugs for acid related disorders > A02B - Drugs for peptic ulcer and gastro-oesophageal reflux disease (gord) C78276 - Agent Affecting Digestive System or Metabolism > C29701 - Anti-ulcer Agent C78272 - Agent Affecting Nervous System > C28197 - Antianxiety Agent D005765 - Gastrointestinal Agents > D000897 - Anti-Ulcer Agents Proglumide is a nonpeptide and orally active cholecystokinin (CCK)-A/B receptors antagonist. Proglumide selective blocks CCK’s effects in the central nervous system (CNS). Proglumide has ability to inhibit gastric secretion and to protect the gastroduodenal mucosa. Proglumide also has antiepileptic and antioxidant activities[1][2][3][4][5].
BOVINE PINEAL ANTIREPRODUCTIVE TRIPEPTIDE ACETATE SALT
C13H26N4O6 (334.18522559999997)
Rubrosterone
Rubrosterone is a natural product found in Taxus wallichiana, Cyanotis arachnoidea, and other organisms with data available.
Tanshinol borneol ester
MinimolideF
(E)-methyl 11-(5-carbamoyl-4-oxo-1,4-dihydropyridin-2-yl)undec-10-enoate_120104
C18H26N2O4 (334.18924760000004)
Mycophenolic Acid Methyl Ester
Methyl mycophenolate is a methyl ester of mycophenolic acid and is also found in marine-derived fungus Phaeosphaeria spartinae[1][2].
C18H22O6_(5E,11E)-7,8,14,16-Tetrahydroxy-3-methyl-3,4,7,8,9,10-hexahydro-1H-2-benzoxacyclotetradecin-1-one
C19H26O3S_2-Propenoic acid, 3-(methylthio)-, (1R,2R,8aR)-1,2,3,4,6,7,8,8a-octahydro-1,8a-dimethyl-7-(1-methylethylidene)-6-oxo-2-naphthalenyl ester, (2E)
C19H26O5_Propanoic acid, 2-methyl-, (3S,3aR,4S,4aR,7aR,8R,9aR)-2,3,3a,4,4a,5,7a,8,9,9a-decahydro-3,4a,8-trimethyl-2,5-dioxoazuleno[6,5-b]furan-4-yl ester
[(1S,3aR,5R,5aR,8aR,9S,9aR)-1,5,8a-trimethyl-2,8-dioxo-3a,4,5,5a,9,9a-hexahydro-1H-azuleno[6,5-b]furan-9-yl] 2-methylpropanoate
[(1S,3aR,5R,5aR,8aR,9S,9aR)-1,5,8a-trimethyl-2,8-dioxo-3a,4,5,5a,9,9a-hexahydro-1H-azuleno[6,5-b]furan-9-yl] 2-methylpropanoate_major
Ala Ala Ser Ser
Ala Gly Ser Thr
Ala Gly Thr Ser
Ala Ser Ala Ser
Ala Ser Gly Thr
Ala Ser Ser Ala
Ala Ser Thr Gly
Ala Thr Gly Ser
Ala Thr Ser Gly
Gly Ala Ser Thr
Gly Ala Thr Ser
Gly Gly Thr Thr
Gly Ser Ala Thr
Gly Ser Thr Ala
Gly Thr Ala Ser
Gly Thr Gly Thr
Gly Thr Ser Ala
Gly Thr Thr Gly
Ser Ala Ala Ser
Ser Ala Gly Thr
Ser Ala Ser Ala
Ser Ala Thr Gly
Ser Gly Ala Thr
Ser Gly Thr Ala
Ser Ser Ala Ala
Ser Thr Ala Gly
Ser Thr Gly Ala
Thr Ala Gly Ser
Thr Ala Ser Gly
Thr Gly Ala Ser
Thr Gly Gly Thr
Thr Gly Ser Ala
Thr Gly Thr Gly
Thr Ser Ala Gly
Thr Ser Gly Ala
Thr Thr Gly Gly
(2-{4-Methyl-2-[(2-methylpropanoyl)oxy]phenyl}oxiran-2-yl)methyl 2-methylbutanoate
(2-{4-methyl-2-[(2-methylpropanoyl)oxy]phenyl}oxiran-2-yl)methyl 3-methylbutanoate
2,6-Dimethyl-7-octene-1,6-diol 8-O-glucoside
trans-p-Menthane-7,8-diol 7-glucoside
trans-p-Menthane-7,8-diol 8-glucoside
3,7-Dimethyl-5-octene-1,7-diol 1-glucoside
TDP 2
amifloxacin
D000970 - Antineoplastic Agents > D059003 - Topoisomerase Inhibitors > D059005 - Topoisomerase II Inhibitors D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D024841 - Fluoroquinolones C254 - Anti-Infective Agent > C258 - Antibiotic > C795 - Quinolone Antibiotic D004791 - Enzyme Inhibitors
6-(((4aR,8aS)-octahydroquinolin-1(2H)-yl)sulfonyl)-1,2,3,4-tetrahydroquinoline
C18H26N2O2S (334.17148960000003)
Threonyl-seryl-lysine
C13H26N4O6 (334.18522559999997)
1-tert-Butyl 4-ethyl 4-(pyridin-4-yl)piperidine-1,4-dicarboxylate
C18H26N2O4 (334.18924760000004)
tert-butyl 4-(2-methoxy-2-oxo-1-phenylethyl)piperazine-1-carboxylate
C18H26N2O4 (334.18924760000004)
benzyl 4-(1-amino-3-ethoxy-3-oxopropyl)piperidine-1-carboxylate
C18H26N2O4 (334.18924760000004)
(R)-3-N-Boc-Amino-1-Cbz-piperidine
C18H26N2O4 (334.18924760000004)
3-Amino-3-(3-cbz)piperidine-propionic acid ethyl ester
C18H26N2O4 (334.18924760000004)
3-AMINO-3-(2-CBZ)PIPERIDINE-PROPIONICACIDETHYLESTER
C18H26N2O4 (334.18924760000004)
Tetroxoprim
C471 - Enzyme Inhibitor > C2153 - Dihydrofolate Reductase Inhibitor D000890 - Anti-Infective Agents
(4-METHYLSULFANYL-PHENYL)-PHOSPHONICACIDDIETHYLESTER
C18H26N2O4 (334.18924760000004)
(2E,6E)-2,6-bis[(3-methoxyphenyl)methylidene]cyclohexan-1-one
(3-BOC-AMINO-PIPERIDIN-1-YL)-PYRIDIN-4-YL-ACETICACID
C18H26N2O4 (334.18924760000004)
(3-acryloxypropyl)methylbis(trimethylsiloxy)silane
5-(4-(5,5-dimethyl-1,3,2-dioxaborinane)phenyl) dipyrromethane (under argon)
C20H23BN2O2 (334.18524879999995)
4-Methyl-3-[[4-(3-pyridinyl)-2-pyrimidinyl]amino]benzoic acid ethyl ester
cis-1-(Boc-aMino)-3-(Cbz-aMino)cyclopentane
C18H26N2O4 (334.18924760000004)
benzyl 4-(2-tert-butoxy-2-oxo-ethyl)piperazine-1-carboxylate
C18H26N2O4 (334.18924760000004)
4-[2-(4-METHOXY-PHENYL)-2-OXO-ETHYL]-PIPERAZINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER
C18H26N2O4 (334.18924760000004)
4-(4-(Tert-butoxycarbonyl)piperazine-1-carbonyl)phenylboronic acid
4-[3-[(1S)-1-(Hexyloxy)ethyl]-2-methoxyphenyl]-2-thiazolamine
C18H26N2O2S (334.17148960000003)
N-(2,4,6-Triisopropylbenzenesulfonyl)imidazole
C18H26N2O2S (334.17148960000003)
METHYL 3-ISOBUTOXY-5-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)BENZOATE
METHYL 3-BUTOXY-5-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)BENZOATE
(R,R)-2,2-(DIMETHYLMETHYLENE)BIS(4-PHENYL-2-OXAZOLINE)
2-[(2-Methyl-4-{[(2-methyl-2-propanyl)oxy]carbonyl}-1-piperazinyl )methyl]benzoic acid
C18H26N2O4 (334.18924760000004)
2-[(3-Methyl-4-{[(2-methyl-2-propanyl)oxy]carbonyl}-1-piperazinyl )methyl]benzoic acid
C18H26N2O4 (334.18924760000004)
3-[(2-Methyl-4-{[(2-methyl-2-propanyl)oxy]carbonyl}-1-piperazinyl )methyl]benzoic acid
C18H26N2O4 (334.18924760000004)
3-[(3-Methyl-4-{[(2-methyl-2-propanyl)oxy]carbonyl}-1-piperazinyl )methyl]benzoic acid
C18H26N2O4 (334.18924760000004)
1-benzyl 4-tert-butyl 2-Methylpiperazine-1,4-dicarboxylate
C18H26N2O4 (334.18924760000004)
tert-Butyl 4-(4-(ethoxycarbonyl)phenyl)piperazine-1-carboxylate
C18H26N2O4 (334.18924760000004)
ETHYL 3-(4-BOC-PIPERAZIN-1-YL)BENZOATE
C18H26N2O4 (334.18924760000004)
2-(4-(tert-Butoxycarbonyl)piperazin-1-yl)-2-(m-tolyl)acetic
C18H26N2O4 (334.18924760000004)
dipropan-2-yl 3-phenylmethoxycyclobutane-1,1-dicarboxylate
1-Benzyl-4-(Boc-amino)piperidine-4-carboxylic Acid
C18H26N2O4 (334.18924760000004)
2-(4-BOC-PIPERAZINYL)-2-(4-METHYLPHENYL)ACETIC ACID
C18H26N2O4 (334.18924760000004)
(S)-2-((TERT-BUTOXYCARBONYL)AMINO)-3-(5-METHOXY-1H-INDOL-3-YL)PROPANOIC ACID
(S)-(3-N-BOC-AMINO-2-OXO-2,3,4,5-TETRAHYDRO-BENZO[B]AZEPIN-1-YL)-ACETIC ACID
GDC-0879
GDC-0879 is a potent and selective B-Raf inhibitor with an IC50 of 0.13 nM.
(2s)-[[[(phenylmethoxy)carbonyl]amino]methyl]-1-pyrrolidinecarboxylic acid 1,1-dimethylethyl ester
C18H26N2O4 (334.18924760000004)
(3-(4-(TERT-BUTOXYCARBONYL)PIPERAZINE-1-CARBONYL)PHENYL)BORONIC ACID
2-(S)-METHYLPIPERAZINE-1,4-DICARBOXYLIC ACID 4-BENZYL ESTER 1-TER-BUTYL ESTER
C18H26N2O4 (334.18924760000004)
(R)-TERT-BUTYL 3-(((BENZYLOXY)CARBONYL)AMINO)PIPERIDINE-1-CARBOXYLATE
C18H26N2O4 (334.18924760000004)
4-[4-(4,4,5,5-TETRAMETHYL-[1,3,2]DIOXABOROLAN-2-YL)-PHENOXY]-BUTYRIC ACID ETHYL ESTER
7-METHOXY-N-(4-(PYRROLIDIN-1-YLMETHYL)PYRIDIN-2-YL)ISOQUINOLIN-3-AMINE
Methyl 3-(2-hydroxyethyl)-2-(triethylsilyl)-1H-pyrrolo[2,3-b]pyri dine-5-carboxylate
C17H26N2O3Si (334.17126060000004)
(S)-N-Cbz-3-N-Boc-aminomethyl-pyrrolidine
C18H26N2O4 (334.18924760000004)
TERT-BUTYL 7-(3-ETHOXY-3-OXOPROPYL)-3,4-DIHYDRO-1,8-NAPHTHYRIDINE-1(2H)-CARBOXYLATE
C18H26N2O4 (334.18924760000004)
TERT-BUTYL 4-[4-(METHOXYCARBONYL)BENZYL]PIPERAZINE-1-CARBOXYLATE
C18H26N2O4 (334.18924760000004)
N-[[4-(dimethylamino)phenyl]-(2-hydroxynaphthalen-1-yl)methyl]acetamide
tert-butyl (4S)-3-(benzyloxycarbonyl)-1-methyl-2-oxoimidazolidine-4-carboxylate
(R)-1-Boc-4-Cbz-2-Methylpiperazine
C18H26N2O4 (334.18924760000004)
2-[4-(4-Methoxy-phenylethynyl)-phenyl]-4,4,5,5-tetramethyl-[1,3,2]dioxaborolane
(RS)-4-[3-(1-hexyloxyethyl)-2-methyloxyphenyl]thiazol-2-ylamine
C18H26N2O2S (334.17148960000003)
(1S,3R)-1-(Boc-aMino)-3-(Cbz-aMino)cyclopentane
C18H26N2O4 (334.18924760000004)
(s)-boc-4-amino-2-carboxymethyl-1,3,4,5-tetrahydro-2h-[2]-benzazepin-3-one
(2R,5S)-rel-Tetrahydro-5-propyl-2-(3,4,5-trifluoro[1,1-biphenyl]-4-yl)-2H-pyran
3-(4-FLUOROPHENYL)-N-(4-(PYRIDIN-4-YLMETHYL)PHENYL)PROPANAMIDE
2-(1-Amino-1-methylethyl)-N-(4-fluorobenzyl)-5-hydroxy-1-methyl-6-oxo-1,6-dihydropyrimidine-4-carboxamide
1-BENZYL-3-BOC-AMINOPIPERIDINE-3-CARBOXYLIC ACID
C18H26N2O4 (334.18924760000004)
10,11-Dimethoxy-4-methyldibenzo[c,f]-2,7-naphthyridine-3,6-diamine
4-(4-Methylpiperazin-1-yl)-7-(trifluoromethyl)pyrrolo[1,2-a]quinoxaline
D018377 - Neurotransmitter Agents > D018490 - Serotonin Agents > D017366 - Serotonin Receptor Agonists
1,3,5-Trimethoxy-2-(2,4,6-trimethoxyphenyl)benzene
(3R,9R)-9-[(3,6-dideoxy-alpha-L-arabino-hexopyranosyl)oxy]-3-hydroxydecanoic acid
(3R)-10-[(3,6-dideoxy-alpha-L-arabino-hexopyranosyl)oxy]-3-hydroxydecanoic acid
Cyclopentanecarboxylic acid, 1-(4-nitrophenyl)-, 2-(diethylamino)ethyl ester
C18H26N2O4 (334.18924760000004)
N(6)-lipoyl-L-lysine
An N(6)-acyl-L-lysine where the N(6)-acyl group is lipoyl.
4-(4-Tert-butylphenoxy)-5-methoxy-2-phenylpyrimidine
4-[[2-(4-Ethyl-3-oxo-2-morpholinyl)-1-oxoethyl]amino]benzoic acid ethyl ester
N-(3,4-dimethylphenyl)-4-oxo-3,10-dihydro-2H-pyrimido[1,2-a]benzimidazole-2-carboxamide
N-(4-methoxyphenyl)-2-(2-methylpropyl)-4-quinolinecarboxamide
9-Fluoro-11beta,17beta-dihydroxy-16alpha-methylandrosta-1,4-dien-3-one
C20H27FO3 (334.19441240000003)
(2S,3S,4S)-2-methoxy-3-[(2E)-6-methylhept-2-en-2-yl]-4-(trifluoroacetyl)cyclohexanone
(3As,3br,4s,5as,6s,8as,8bs)-6-acetyl-3b-fluoro-4-hydroxy-3a,5a-dimethyl-3a,3b,4,5,5a,6,7,8,8a,8b,9,10-dodecahydrodicyclopenta[a,f]naphthalen-2(3h)-one
C20H27FO3 (334.19441240000003)
Methyl mycophenolate
Methyl mycophenolate is a methyl ester of mycophenolic acid and is also found in marine-derived fungus Phaeosphaeria spartinae[1][2].
(R)-(-)-Combretastatin
C274 - Antineoplastic Agent > C186664 - Cytotoxic Chemotherapeutic Agent > C273 - Antimitotic Agent D050258 - Mitosis Modulators > D050256 - Antimitotic Agents > D050257 - Tubulin Modulators D000970 - Antineoplastic Agents > D050256 - Antimitotic Agents
N-(Para-glutaramidophenyl-ethyl)-piperidinium-N-oxide
C18H26N2O4 (334.18924760000004)
(3S)-N-(5-chloro-2-methylphenyl)-1-cyclohexyl-5-oxopyrrolidine-3-carboxamide
(3s)-N-(3-Chloro-2-Methylphenyl)-1-Cyclohexyl-5-Oxopyrrolidine-3-Carboxamide
Pimobendan
D004791 - Enzyme Inhibitors > D010726 - Phosphodiesterase Inhibitors D002317 - Cardiovascular Agents > D014665 - Vasodilator Agents C471 - Enzyme Inhibitor > C744 - Phosphodiesterase Inhibitor D020011 - Protective Agents > D002316 - Cardiotonic Agents
[(10S,12S,13E,16S,18R)-13-ethylidene-8,15-diazahexacyclo[14.2.1.01,9.02,7.010,15.012,17]nonadeca-2,4,6,8-tetraen-18-yl] acetate
(2R,4S,5S,6S)-5-acetamido-6-[(1S,2S)-1-acetamido-2-hydroxypropyl]-2,4-dihydroxyoxane-2-carboxylic acid
(2S,4R,5R,6S)-5-acetamido-6-[(1S,2S)-1-acetamido-2-hydroxypropyl]-2,4-dihydroxyoxane-2-carboxylic acid
(2S,4R,5R,6S)-5-acetamido-6-[(1S,2R)-1-acetamido-2-hydroxypropyl]-2,4-dihydroxyoxane-2-carboxylic acid
2-[[(2R)-2-amino-3-(4-hydroxy-1-oxononan-3-yl)sulfanylpropanoyl]amino]acetic acid
(1,8a-dimethyl-6-oxo-7-prop-1-en-2-yl-1,2,3,4,7,8-hexahydronaphthalen-2-yl) (E)-3-methylsulfanylprop-2-enoate
[3-Carboxy-2-(7-carboxy-4-hydroxyheptanoyl)oxypropyl]-trimethylazanium
C15H28NO7+ (334.18656780000003)
[3-Carboxy-2-(7-carboxy-3-hydroxyheptanoyl)oxypropyl]-trimethylazanium
C15H28NO7+ (334.18656780000003)
[3-Carboxy-2-[6-(2-hydroxyethoxy)-6-oxohexanoyl]oxypropyl]-trimethylazanium
C15H28NO7+ (334.18656780000003)
Benzamide, N-[[4-(2-cyanophenyl)-1-piperazinyl]methyl]-3-methyl-
Benzoic acid, 4-amino-, 4-acetoxy-2,2,6,6-tetramethyl-1-piperidinyl ester
C18H26N2O4 (334.18924760000004)
3-(4-Butyl-3,5-dimethyl-1-pyrazolyl)-5-methyl-[1,2,4]triazino[5,6-b]indole
alpha-N-Carbobenzyloxy-epsilon-N-acryloyl-L-lysine
(4aR,8aR,15bR)-4a,5,5a,7,8,13a,15,15a,15b,16-decahydro-2H-4,6-methanoindolo[3,2,1-ij]oxepino[2,3,4-de]pyrrolo[2,3-h]quinoline-14-one
2-Tert-butyl-4-chloro-5-(3-methyl-5-propan-2-ylphenoxy)-3-pyridazinone
2-(2-Furanyl)-5-[4-(phenylmethyl)-1-piperazinyl]-4-oxazolecarbonitrile
3,3-Dimethyl-1,5-dinitro-6-phenoxy-3-azoniabicyclo[3.3.1]non-6-ene
N3-(2,4-Dimethylphenyl)-N1-phenylpyrazole-1,3-dicarboxamide
6-(3,5-dimethyl-4-isoxazolyl)-N-[1-(2-furanyl)ethyl]-4-quinazolinamine
Ethyl (3E)-3-phenyl-3-(quinazolin-4-ylhydrazinylidene)propanoate
1-hydroxy-3-{[2-(1,1-dimethylallyl)-indol-3-yl]methyl}-6H,7H,8H-5lambda(5)-pyrrolo[1,2-a]pyrazine
5-{N-[4-(4-cyanostyryl)phenyl]-N-methylamino}pentanoic acid
methyl 8-oxo-8-[(2E)-2-[(2R,3S,4R)-2,3,4,5-tetrahydroxypentylidene]hydrazinyl]octanoate
2-[(2E)-2-[1-(4-methoxyphenyl)ethylidene]hydrazinyl]-4-phenyl-1H-pyrimidin-6-one
2-[(E)-[(8-methoxy-8-oxooctanoyl)hydrazinylidene]methyl]benzoic acid
N-(cyclopropylmethyl)-2-[(2S,5R,6R)-5-(ethylsulfonylamino)-6-(hydroxymethyl)-2-oxanyl]acetamide
2-[(1R,3R,4aR,9aS)-6-(dimethylamino)-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N,N-dimethylacetamide
C18H26N2O4 (334.18924760000004)
tert-Butyl 2-(allylthio)-2-(4-methoxyphenyl)pent-4-enoate
(1R,2S,4aR,4bR,7R,9aR,10S,10aR)-2-fluoro-1-methyl-8-methylidene-13-oxododecahydro-4a,1-(epoxymethano)-7,9a-methanobenzo[a]azulene-10-carboxylic acid
(9R)-9-fluoro-6,11-dihydroxy-10,17,17-trimethyl-2,6,7,8,11,12,15,16-octahydro-1H-cyclopenta[a]phenanthren-3-one
C20H27FO3 (334.19441240000003)
(9S,10R,13R,17R)-9-fluoro-17-hydroxy-10,13,17-trimethyl-2,6,7,8,12,14,15,16-octahydro-1H-cyclopenta[a]phenanthrene-3,11-dione
C20H27FO3 (334.19441240000003)
(9S,10R,17R)-9-fluoro-17-hydroxy-10,13,17-trimethyl-2,6,7,8,12,14,15,16-octahydro-1H-cyclopenta[a]phenanthrene-3,11-dione
C20H27FO3 (334.19441240000003)
N-[(Z)-[2-(1H-imidazol-2-yl)-1-phenylethylidene]amino]-4-methoxybenzamide
S-(4-hydroxy-1-oxononan-3-yl)cysteinylglycine
A dipeptide that is cysteinylglycine in which the thiol hydrogen has been replaced by a 4-hydroxy-1-oxononan-3-yl group.
4-formamido-alpha-D-threo-pentopyranosyl-(1->3)-4-formamido-alpha-D-rhamnopyranose
(9S,17R)-9-fluoro-17-hydroxy-10,13,17-trimethyl-2,6,7,8,12,14,15,16-octahydro-1H-cyclopenta[a]phenanthrene-3,11-dione
C20H27FO3 (334.19441240000003)
[(E)-3-(Methylthio)acrylic acid](1R)-1beta,8abeta-dimethyl-6-oxo-7-isopropylidene-1,2,3,4,6,7,8,8a-octahydronaphthalene-2alpha-yl ester
Anti-4,5,8-trifluoro-6-methoxy-12,14,16-trimethyl(2.2)metacyclophane
(1R,14E,19S,21S)-14-(2-hydroxyethylidene)-8,16-diazahexacyclo[11.5.2.11,8.02,7.016,19.012,21]henicosa-2,4,6,12-tetraen-9-one
[3-(3-Acetyloxy-2-propanoyloxypropoxy)-1-carboxypropyl]-trimethylazanium
C15H28NO7+ (334.18656780000003)
4-Chlorodehydromethyltestosterone
D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones
3-(2-Methylpropanoyloxy)-8-(3-methylbutanoyloxy)-9,10-epoxy-p-mentha-1,3,5-triene
(2R)-2-amino-6-[5-(1,2-dithiolan-3-yl)pentanamido]hexanoic acid
Spectinomycin(2+)
An organic cation obtained by protonation of the secondary amino groups of spectinomycin.
9-Fluoro-11beta-hydroxy-A-norpregn-3(5)-ene-2,20-dione
C20H27FO3 (334.19441240000003)
3-O-alpha-L-rhamnopyranosyl-3-hydroxydecanoic acid
Hypidone (hydrochloride)
Hypidone hydrochloride (YL0919) is an orally active antidepressant agent with dual activity as a highly seletive 5-HT uptake blocker and an effective 5-HT1A?receptor agonist (Ki=0.19 nM). Hypidone hydrochloride inhibits the uptake of [3H]-5-HT into rat cerebral cortical synaptosomes and HEK293 cells with IC50s of 1.78 nM and 1.93 nM, respectively. Hypidone hydrochloride shows remarkable antidepressant effects in animal models and has the poential for the investigation of depressive disorder[1].