Exact Mass: 334.1721
Exact Mass Matches: 334.1721
Found 500 metabolites which its exact mass value is equals to given mass value 334.1721
,
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-16alpha-hydroxyandrost-4-ene-3,11,17-trione
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
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.
Strychnin
Proglumide
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].
Tetroxoprim
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
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
Subcordatolide C
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
(?)-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
8alpha-Hydroxy-1alpha-(isobutyryloxy)cyclocostunolid
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
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
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
2,2-(1,1-methylenebis(1H-indole-3,1-diyl))diethanol
5alpha,11,12-trihydroxy-6-oxa-abieta-8,11,13-trien-7-one
(+/-)-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-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
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
8beta-isobutyryloxy-1beta,10alpha-epoxycostunolide
1beta-acetoxy-8beta-ethoxy-eudesman-4(15),7(11)-dien-8alpha,12-olide
9beta-isobutyryloxy-1alpha,10beta-epoxyhaageanolide
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
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.))-
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
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
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
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
(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
TDP 2
6-(((4aR,8aS)-octahydroquinolin-1(2H)-yl)sulfonyl)-1,2,3,4-tetrahydroquinoline
1-tert-Butyl 4-ethyl 4-(pyridin-4-yl)piperidine-1,4-dicarboxylate
tert-butyl 4-(2-methoxy-2-oxo-1-phenylethyl)piperazine-1-carboxylate
benzyl 4-(1-amino-3-ethoxy-3-oxopropyl)piperidine-1-carboxylate
3-Amino-3-(3-cbz)piperidine-propionic acid ethyl ester
3-AMINO-3-(2-CBZ)PIPERIDINE-PROPIONICACIDETHYLESTER
Tetroxoprim
C471 - Enzyme Inhibitor > C2153 - Dihydrofolate Reductase Inhibitor D000890 - Anti-Infective Agents
(4-METHYLSULFANYL-PHENYL)-PHOSPHONICACIDDIETHYLESTER
(2E,6E)-2,6-bis[(3-methoxyphenyl)methylidene]cyclohexan-1-one
(3-BOC-AMINO-PIPERIDIN-1-YL)-PYRIDIN-4-YL-ACETICACID
5-(4-(5,5-dimethyl-1,3,2-dioxaborinane)phenyl) dipyrromethane (under argon)
benzyl 4-(2-tert-butoxy-2-oxo-ethyl)piperazine-1-carboxylate
4-[2-(4-METHOXY-PHENYL)-2-OXO-ETHYL]-PIPERAZINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER
4-(4-(Tert-butoxycarbonyl)piperazine-1-carbonyl)phenylboronic acid
4-[3-[(1S)-1-(Hexyloxy)ethyl]-2-methoxyphenyl]-2-thiazolamine
(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
2-[(3-Methyl-4-{[(2-methyl-2-propanyl)oxy]carbonyl}-1-piperazinyl )methyl]benzoic acid
3-[(2-Methyl-4-{[(2-methyl-2-propanyl)oxy]carbonyl}-1-piperazinyl )methyl]benzoic acid
3-[(3-Methyl-4-{[(2-methyl-2-propanyl)oxy]carbonyl}-1-piperazinyl )methyl]benzoic acid
1-benzyl 4-tert-butyl 2-Methylpiperazine-1,4-dicarboxylate
tert-Butyl 4-(4-(ethoxycarbonyl)phenyl)piperazine-1-carboxylate
2-(4-(tert-Butoxycarbonyl)piperazin-1-yl)-2-(m-tolyl)acetic
dipropan-2-yl 3-phenylmethoxycyclobutane-1,1-dicarboxylate
1-Benzyl-4-(Boc-amino)piperidine-4-carboxylic Acid
2-(4-BOC-PIPERAZINYL)-2-(4-METHYLPHENYL)ACETIC ACID
(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
(2s)-[[[(phenylmethoxy)carbonyl]amino]methyl]-1-pyrrolidinecarboxylic acid 1,1-dimethylethyl ester
(3-(4-(TERT-BUTOXYCARBONYL)PIPERAZINE-1-CARBONYL)PHENYL)BORONIC ACID
2-(S)-METHYLPIPERAZINE-1,4-DICARBOXYLIC ACID 4-BENZYL ESTER 1-TER-BUTYL ESTER
(R)-TERT-BUTYL 3-(((BENZYLOXY)CARBONYL)AMINO)PIPERIDINE-1-CARBOXYLATE
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
TERT-BUTYL 7-(3-ETHOXY-3-OXOPROPYL)-3,4-DIHYDRO-1,8-NAPHTHYRIDINE-1(2H)-CARBOXYLATE
TERT-BUTYL 4-[4-(METHOXYCARBONYL)BENZYL]PIPERAZINE-1-CARBOXYLATE
N-[[4-(dimethylamino)phenyl]-(2-hydroxynaphthalen-1-yl)methyl]acetamide
tert-butyl (4S)-3-(benzyloxycarbonyl)-1-methyl-2-oxoimidazolidine-4-carboxylate
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
(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
Cyclopentanecarboxylic acid, 1-(4-nitrophenyl)-, 2-(diethylamino)ethyl ester
4-(4-Tert-butylphenoxy)-5-methoxy-2-phenylpyrimidine
4-[[2-(4-Ethyl-3-oxo-2-morpholinyl)-1-oxoethyl]amino]benzoic acid ethyl ester
N-(4-methoxyphenyl)-2-(2-methylpropyl)-4-quinolinecarboxamide
(2S,3S,4S)-2-methoxy-3-[(2E)-6-methylhept-2-en-2-yl]-4-(trifluoroacetyl)cyclohexanone
N-(Para-glutaramidophenyl-ethyl)-piperidinium-N-oxide
[(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
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
[3-Carboxy-2-(7-carboxy-3-hydroxyheptanoyl)oxypropyl]-trimethylazanium
[3-Carboxy-2-[6-(2-hydroxyethoxy)-6-oxohexanoyl]oxypropyl]-trimethylazanium
Benzamide, N-[[4-(2-cyanophenyl)-1-piperazinyl]methyl]-3-methyl-
Benzoic acid, 4-amino-, 4-acetoxy-2,2,6,6-tetramethyl-1-piperidinyl ester
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
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-[(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
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
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.
[(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
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
Spectinomycin(2+)
An organic cation obtained by protonation of the secondary amino groups of spectinomycin.
1-[(2r)-4-hydroxy-2-(2-hydroxypropan-2-yl)-6-methoxy-7-(3-methylbut-2-en-1-yl)-2,3-dihydro-1-benzofuran-5-yl]ethanone
5,8-dihydroxy-3,6,9-trimethylidene-4-(2-methylpropoxy)-octahydroazuleno[4,5-b]furan-2-one
(3as,4s,5s,11ar)-5-hydroxy-10-methyl-3-methylidene-4-(2-methylpropoxy)-2-oxo-3ah,4h,5h,8h,9h,11ah-cyclodeca[b]furan-6-carbaldehyde
(2s,4s,4as,5z,7s)-7-(acetyloxy)-4,4a,6-trimethyl-8-oxo-2,3,4,7,9,10-hexahydrobenzo[8]annulen-2-yl acetate
(1s,2s,7r,10r,11r,12r)-4-hydroxy-1,5-dimethyl-9-oxo-8-oxatetracyclo[8.3.1.0²,⁶.0⁷,¹¹]tetradec-5-en-12-yl 2-methylpropanoate
(1s,2s,5s,6r,7s,10r,12r,14s)-5,14-dimethyl-9-methylidene-4-oxo-3,13-dioxatetracyclo[8.4.0.0²,⁶.0¹²,¹⁴]tetradecan-7-yl 2-methylpropanoate
(3s)-14-hydroxy-16-methoxy-3-methyl-4,5,6,7,8,9,10,12-octahydro-3h-2-benzoxacyclotetradecine-1,11-dione
(4s,4ar,5s,8s,8ar)-8-hydroxy-3,4a,5-trimethyl-9-oxo-4h,5h,6h,7h,8h,8ah-naphtho[2,3-b]furan-4-yl 2-methylpropanoate
6-[hydroxy(4-hydroxyphenyl)methyl]-1,5-dimethoxy-3-(sec-butyl)pyrazin-2-one
{4-hydroxy-6-methyl-3-methylidene-2-oxo-3ah,4h,7h,8h,11h,11ah-cyclodeca[b]furan-10-yl}methyl 2-methylpropanoate
(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
(3as,4r,5r,6ar,8s,9ar,9br)-5,8-dihydroxy-3,6,9-trimethylidene-4-(2-methylpropoxy)-octahydroazuleno[4,5-b]furan-2-one
2-[(1r,4ar,5r,6s,7r,8ar)-6,7-dihydroxy-5-(hydroxymethyl)-8a-methyl-2-methylidene-octahydronaphthalen-1-yl]-1-(furan-3-yl)ethanone
(1r,10r,16s)-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
(1r)-1-{3-methoxy-4-[(2-methylpropanoyl)oxy]phenyl}prop-2-en-1-yl 3-methylbutanoate
(3as,4r,9r,11ar)-9-hydroxy-6,10-dimethyl-3-methylidene-2-oxo-3ah,4h,7h,8h,9h,11ah-cyclodeca[b]furan-4-yl 2-methylpropanoate
(1s,3s,4s,6s,9e,11r)-4,9-dimethyl-14-methylidene-13-oxo-5,12-dioxatricyclo[9.3.0.0⁴,⁶]tetradec-9-en-3-yl 2-methylpropanoate
3,4a,8-trimethyl-2,5-dioxo-3h,3ah,4h,7ah,8h,9h,9ah-azuleno[6,5-b]furan-4-yl 2-methylpropanoate
{4-[(2r)-2-methyloxiran-2-yl]-3-[(2-methylpropanoyl)oxy]phenyl}methyl 3-methylbutanoate
(3as,4ar,7as,9ar)-3,4a,8-trimethyl-2,5-dioxo-3h,3ah,4h,7ah,8h,9h,9ah-azuleno[6,5-b]furan-4-yl 2-methylpropanoate
4,8-dimethyl-12-methylidene-13-oxo-3,14-dioxatricyclo[9.3.0.0²,⁴]tetradec-7-en-10-yl 2-methylpropanoate
2-{2-[(1-hydroxyethylidene)amino]-n,3-dimethylpentanamido}-3-phenylpropanoic acid
4-hydroxy-3,4a,5-trimethyl-2-oxo-3h,4h,5h,6h,7h,8h,8ah,9h-naphtho[2,3-b]furan-6-yl 2-methylprop-2-enoate
10-(1-hydroxy-4-methyl-2,5-dioxocyclohex-3-en-1-yl)-4,8-dimethyldeca-4,8-dienoic acid
(3ar,4s,5ar,6r,9as,9br)-6-hydroxy-5a-methyl-3,9-dimethylidene-2-oxo-octahydronaphtho[1,2-b]furan-4-yl 2-methylpropanoate
3-[(4-hydroxyphenyl)methyl]-4-(2-methylpropyl)-5-(phenylmethylidene)furan-2-one
(4s,9s,11as)-9-hydroxy-6,10-dimethyl-3-methylidene-2-oxo-3ah,4h,7h,8h,9h,11ah-cyclodeca[b]furan-4-yl 2-methylpropanoate
(4r,5r,6s,7r)-6-(acetyloxy)-4,8-dimethyl-2-oxo-1-(propan-2-ylidene)spiro[4.5]dec-8-en-7-yl acetate
(3as,4r,11s,11ar)-4-hydroxy-6,10-dimethyl-3-methylidene-2-oxo-3ah,4h,7h,8h,11h,11ah-cyclodeca[b]furan-11-yl 2-methylpropanoate
8-hydroxy-3,4a,5-trimethyl-9-oxo-4h,5h,6h,7h,8h,8ah-naphtho[2,3-b]furan-6-yl 2-methylpropanoate
5,9,14-trimethyl-4-oxo-3,13-dioxatetracyclo[8.4.0.0²,⁶.0¹²,¹⁴]tetradec-9-en-7-yl 2-methylpropanoate
(3r,5s,6s)-3-hydroxy-6,8-dimethyl-6-(3-methylbut-2-en-1-yl)-9-(2-oxopropyl)-1-oxaspiro[4.5]dec-8-ene-2,7-dione
8-hydroxy-9-methyl-2-[(2-methylbut-2-en-1-yl)oxy]-14-methylidene-5,12-dioxatricyclo[9.3.0.0⁴,⁶]tetradec-9-en-13-one
(1's,2s,2'r,7'r,9'r,10'r,11's)-10'-hydroxy-1',2',5'-trimethyl-8'-oxaspiro[oxirane-2,12'-tricyclo[7.2.1.0²,⁷]dodecan]-5'-en-11'-yl but-2-enoate
(3as,4r,4as,7r,7ar,8s,9as)-7-hydroxy-4a,8-dimethyl-3-methylidene-2-oxo-octahydro-3ah-azuleno[6,5-b]furan-4-yl (2e)-but-2-enoate
3a,7,8-trihydroxy-9a,11a-dimethyl-2h,3h,5ah,6h,7h,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthrene-1,5-dione
[(3as,6s,6as,9ar,9br)-9a-methyl-3-methylidene-2,9-dioxo-octahydroazuleno[4,5-b]furan-6-yl]methyl 2-methylpropanoate
(4ar,5r,6r,8s,8as)-8-hydroxy-3,4a,5-trimethyl-9-oxo-4h,5h,6h,7h,8h,8ah-naphtho[2,3-b]furan-6-yl 2-methylpropanoate
(3ar,5ar,7r,8s,9ar,9bs,11as)-3a,7,8-trihydroxy-9a,11a-dimethyl-2h,3h,5ah,6h,7h,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthrene-1,5-dione
[(1s,5z,9r,10s)-6-[(acetyloxy)methyl]-10-methyl-2-methylidene-7-oxobicyclo[7.2.0]undec-5-en-10-yl]methyl acetate
10'-hydroxy-1',2',5'-trimethyl-8'-oxaspiro[oxirane-2,12'-tricyclo[7.2.1.0²,⁷]dodecan]-5'-en-11'-yl but-2-enoate
(3ar,4r,6r,6ar,9ar,9br)-6-hydroxy-6,9-dimethyl-3-methylidene-2-oxo-3ah,4h,5h,6ah,7h,9ah,9bh-azuleno[4,5-b]furan-4-yl 2-methylpropanoate
acronyculatinb
{"Ingredient_id": "HBIN014615","Ingredient_name": "acronyculatinb","Alias": "NA","Ingredient_formula": "C19H26O5","Ingredient_Smile": "CC(=CCC1=C2C(=C(C(=C1OC)C(=O)C)O)CC(O2)C(C)(C)O)C","Ingredient_weight": "334.4 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "572","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "11067612","DrugBank_id": "NA"}
Barbatin C
{"Ingredient_id": "HBIN017591","Ingredient_name": "Barbatin C","Alias": "NA","Ingredient_formula": "C19H26O5","Ingredient_Smile": "CC1=CCCC2C1(C(C(C(C2C=CC3=CC(=O)OC3)(C)O)O)O)C","Ingredient_weight": "334.4 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "34134","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "101401700","DrugBank_id": "NA"}