Exact Mass: 254.1742672
Exact Mass Matches: 254.1742672
Found 500 metabolites which its exact mass value is equals to given mass value 254.1742672
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Michlers base
CONFIDENCE standard compound; INTERNAL_ID 1285; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5462; ORIGINAL_PRECURSOR_SCAN_NO 5460 CONFIDENCE standard compound; INTERNAL_ID 1285; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5478; ORIGINAL_PRECURSOR_SCAN_NO 5477 CONFIDENCE standard compound; INTERNAL_ID 1285; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5474; ORIGINAL_PRECURSOR_SCAN_NO 5472 CONFIDENCE standard compound; INTERNAL_ID 1285; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5455; ORIGINAL_PRECURSOR_SCAN_NO 5454 CONFIDENCE standard compound; INTERNAL_ID 1285; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5451; ORIGINAL_PRECURSOR_SCAN_NO 5450 CONFIDENCE standard compound; INTERNAL_ID 1285; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5482; ORIGINAL_PRECURSOR_SCAN_NO 5480
Adopron
D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones
Chanoclavine-I aldehyde
An enal resulting from the oxidation of the primary alcohol group of chanoclavine-I to the corresponding aldehyde.
(3beta,9beta)-7-Drimene-3,11,12-triol
(3beta,9beta)-7-Drimene-3,11,12-triol is found in mushrooms. (3beta,9beta)-7-Drimene-3,11,12-triol is a constituent of Marasmius oreades (fairy ring mushroom) Constituent of Marasmius oreades (fairy ring mushroom). (3beta,9beta)-7-Drimene-3,11,12-triol is found in mushrooms.
(+)-Setoclavine
(+)-Setoclavine is found in cereals and cereal products. (+)-Setoclavine is an alkaloid from ergot found on Pennisetum typhoideum (pearl millet). Alkaloid from ergot found on Pennisetum typhoideum (pearl millet). (+)-Setoclavine is found in cereals and cereal products.
Kessyl glycol
Constituent of the rhizomes of Valeriana officinalis (valerian). Kessyl glycol is found in tea, fats and oils, and herbs and spices. Kessyl glycol is found in fats and oils. Kessyl glycol is a constituent of the rhizomes of Valeriana officinalis (valerian).
8-Hydroxy-4(6)-lactarene-5,14-diol
8-Hydroxy-4(6)-lactarene-5,14-diol is a constituent of Lactarius piperatus Constituent of Lactarius piperatus
7-Drimene-11,12,14-triol
7-Drimene-11,12,14-triol is found in mushrooms. 7-Drimene-11,12,14-triol is a metabolite of Marasmius oreades (fairy ring mushroom). Metabolite of Marasmius oreades (fairy ring mushroom). 7-Drimene-11,12,14-triol is found in mushrooms.
18-Nor-4(19),8,11,13-abietatetraene
18-Nor-4(19),8,11,13-abietatetraene is isolated from oleoresin of Pinus koraiensis (Korean pine). Isolated from oleoresin of Pinus koraiensis (Korean pine)
Lubiminol
Lubiminol is found in alcoholic beverages. Lubiminol is isolated from infected potatoe Isolated from infected potatoes. Lubiminol is found in alcoholic beverages and potato.
5-Acetoxydihydrotheaespirane
5-Acetoxydihydrotheaespirane is a flavouring ingredient. Flavouring ingredient
2-({2-[Dimethyl(2-phosphanylethyl)ammonio]ethyl}dimethylammonio)ethyl phosphinite
2-({2-[Dimethyl(2-phosphanylethyl)ammonio]ethyl}dimethylammonio)ethyl phosphinite belongs to the family of Cholines. These are organic compounds containing a N,N,N-trimethylethanolammonium cation.
Phenbenzamine
Promethazine is a first-generation ethylenediamine H1-antihistamine.
3-(4-Methylbenzylidene)camphor
4-(8-Amino-1,2,3,4-tetrahydro-2-methyl-4-isoquinolinyl)phenol
Elymoclavine
Isolysergol
7,7-Dimethyl-1-[2-(4-methylphenyl)ethenyl]bicyclo[2.2.1]heptan-2-one
Pterocarpdiolone
4-Chloro-3,7(14)-chamigradien-9-ol
C15H23ClO (254.14373379999998)
Isochenopotriol
2-(2-Hydroxy-4-methylphenyl)-3-(2-methylpropoxy)-1,2-propanediol
Longilobol
Aspergillide B
A macrolide that is 4,15-dioxabicyclo[9.3.1]pentadec-9-en-3-one substituted by a hydroxy group at position 14 and a methyl group at position 5 (the 1S,5S,9E,11R,14S stereoisomer). It is isolated from the marine-derived fungus Aspergillus ostianus and exhibits cytotoxic activity against mouse lymphocytic leukemia cells (L1210).
[3R-(3R*,5S*,6E,9S*)]-3,7,11-trimethyl-1,6,10-dodecatriene-3,5,9-triol
(E,Z,E)-6-(Hydroxymethyl)-2,10-dimethyl-2,6,10-dodecatriene-1,12-diol
Chenopotriol
6alpha,15alpha-Epoxy-1beta,4beta-dihydroxyeudesmane
Kudtriol
alpha-Epoxykudtdiol
3-epi-Chenopotriol
5-epi-Kudtriol
N-methyl-N-[3-phenyl-3-(pyridin-2-yl)propyl]formamide
2alpha,8alpha,11-trihydroxy-5-epi-eremophil-1(10)-ene
1alpha,10beta,4beta,5alpha-diepoxy-7alphaH-germacran-6beta-ol|6beta-hydroxy-(1alpha,10beta),(4beta,5alpha)-diepoxygermacrane
(-)-(2S,3S,4S,6S,7S)-tremul-1(10)-ene-4,11,12-triol
(-)-3beta,4alpha-dihydroxy-beta-dihydroagarofuran|(3beta,4alpha)-3,4-Dihdroxydihydro-beta-agarofuran|3,4-Dihydroxydihydroagarofuran|3S,4R,5R,7R,10R-3,4-dihydroxy-dihydro-beta-agarofuran
(6S,7S,11R)-2-chloro-3,7,11-trimethyl-10-methylidenespiro[5.5]undec-2-en-7-ol
C15H23ClO (254.14373379999998)
(6,8-Bis-hydroxymethyl-4-isopropyl-7-methylene-bicyclo[3.2.1]oct-1-yl)-methanol
4,5-dihydro4beta.5alpha-dihydrooxyoblongolide|oblongolide R
(1R)-1-hydroxybisabololoxide|11-hydroxybisabolol oxide B
(2R*,4S*,5E)-1,4-epoxy-2-hydroxy-7-isopropyl-4-methyl-5-undecen-10-one
6,10-dimethyl-3-propan-2-yl-11-oxabicyclo[8.1.0]undec-6-ene-2,8-diol
(1beta,3beta,4beta,5E)-5,10(14)-Germacradiene-1,3,4-triol
4-hydroxy-4,5-seco-caryophyllen-5-oic acid|7xi-7-Hydroxy-6,7-seco-3(15)-caryophyllen-6-oic acid
6alpha-acetyl-4beta,5beta-dimethyl-1(10)alpha-epoxy-2beta,7beta-dihydroxydecalin|laevinol G
(2R,4aS,5R,7aR,4R)-(-)-7a-methyl-botryodioxanenone
(1beta,6alpha,10alpha)-guai-4(15)-ene-6, 7,10-triol|(3aRS,4RS,5RS,8SR,8aSR)-decahydro-8-methyl-3-methylene-5-(1-methylethyl)azulene-4,5,8-triol
(1(10)E,2beta,5alpha,6beta)-form-1(10),4(15)-Germacradiene-2,5,6-triol
(3E,9Z)-6-Hydroxy-7-chloro-pentadeca-3,9-dien-1-yne|12, 13-Dihydro-(3E, 6S, 7S, 9Z, 12Z)-7-Chloro-3, 9, 12-pentadecatrien-1-yn-6-ol
C15H23ClO (254.14373379999998)
(1R,2R)-dihydroxyisodauc-4-en-14-ol|(1S,3aS,4R,5R,8aR)-1,2,3,3a,4,5,6,8a-octahydro-7-(hydroxymethyl)-3a-methyl-1-(1-methylethyl)-azulene-4,5-diol
(3beta,6alpha,7alpha)-form-3,15-Epoxy-6,7-caryophyllanediol|1beta,12-epoxy-8alpha(S),9alpha(R)-dihydroxycaryophyllene
Lysergol
An alkaloid of the ergoline family that occurs as a minor constituent in some species of fungi and in the morning glory family of plants. Its structure is that of ergoline with a methyl group at N-6 and a beta-hydroxymethyl substituent at C-8. D002492 - Central Nervous System Depressants > D014149 - Tranquilizing Agents > D014150 - Antipsychotic Agents D002491 - Central Nervous System Agents > D011619 - Psychotropic Drugs > D014149 - Tranquilizing Agents D002491 - Central Nervous System Agents > D002492 - Central Nervous System Depressants Origin: Plant; SubCategory_DNP: Alkaloids derived from tryptophan, Ergot alkaloids, Clavine alkaloid
1beta,2beta-epoxycupara-3beta,4beta-diol|infuscol D
(-)-(2S,3S,6S,7S,9S)-tremul-1(10)-ene-11,12,15-triol
(1R,2R,5S,6S,7R,10S)*-ax-4(15)-ene-1alpha,2beta,7beta-triol
(1(10)E,4alpha,5alpha,6beta,8beta)-4,5-Epoxy-1(10)-germacrene-6,8-diol
3alpha,8alpha-dihydroxy-7beta,10alpha-H-eremophil-11(13)-ene
[1R-(1alpha,2beta,4abeta,7beta,8aalpha)]-Decahydro-2-(1-hydroxy-1-methylethyl)-4a-methyl-8-methylene-1,7-naphthalenediol
1beta,6alpha-dihydroxy-4alpha(15)-epoxyeudesmane|4alpha,15-epoxyeudesmane-1beta,6alpha-diol|4alpha,15-epoxyeudesmene-1beta,6alpha-diol|4??,15-Epoxyeudesmane-1??,6??-diol
(E,E)-3,7,11-trimethyl-1,6,9-dodecatrien-3,5,11-triol|5,11-dihydroxy-8,9-dihydro-9,10-dehydronerolidol
3-Hydroxy-4-methyl-6-(1-methyl-1,2-dihydroxyethyl)-4,4a,5,6,7,8-hexahydronaphthalene-2(3H)-one
(1R*,2R*,4aR*,7R*)-1,2,3,4,4a,5,6,7-octahydro-4a,8-dimethyl-2-(1-methylethyl)naphthalene-1,2,7-triol|eudesm-4-ene-3alpha,6alpha,7alpha-triol
1alpha,10beta;4beta,5alpha-diepoxy-7alpha-germacran-6beta-ol
(6S,13R)-6,13-dihydroxy-2E,4E,8E-tetradecatrienoic acid
(E)-4-hydroxy-7-isopropyl-4-methylundec-5-ene-2,10-dione|4-Hydroxy-7-isopropyyl-4-methyl-5-undecene-2,10-dione
4-(3-hydroxy-1,5-dimethylhexyl)-1-cyclohexene-1-carboxylic acid
(1S,2S,4S,4aR,8aS)-1,2,3,4,4a,7,8,8a-octahydro-6-hydroxymethyl-1-methyl-4-(1-methylethyl)naphthalene-1,2-diol|dendronobilin G
11(13)-eudesmene-3,4,12-triol|3beta-hydroxyilicic alcohol
1beta-hydroxy-6,7alpha-dihydroxyeudesm-4(15)-ene
A eudesmane sesquiterpenoid in which the eudesmane skeleton carries hydroxy substituents at position 1, 6 and 7 and a double bond between C-4 and C-14. It has been isolated from the aerial parts of Tephrosia candida.
(1S,1aR,4R,4aS,6S,7S,7aR,7bS)-decahydro-1-(hydroxymethyl)-1,4,7-trimethyl-1H-cyclopropa[e]azulene-4,6-diol|3beta,13-dihydroxyledol
(1R,4R,4aR,8aR)-1,2,3,4,4a,7,8,8a-octahydro-6-(hydroxymethyl)-4-[1-hydroxypropan-2-yl]-1-methylnaphthalen-1-ol|12,15-dihydroxy-alpha-cadinol|agripilol C
negunfurol|rel-(3S,7R,10R)-3,11-dihydroxy-7,10-epoxy-3,7,11-trimethyldodeca-1,5-diene
8-(hydroxymethyl)-1-(2-hydroxy-1-methylethyl)-4-methylspiro[4.5]dec-8-en-7-ol
(1S,3aR,7S,9S,9aR)-decahydro-1,4,7,8-tetramethyl-1H-4,8-epoxycyclopenta[8]annulene-1,9-diol|tuberculariol D
(4aS)-2c-Hydroxy-2t.5.5.8at-tetramethyl-(4arH)-decahydro-naphthoesaeure-(1t)|8-hydroxy-drimanoic acid-(11)|8-Hydroxy-drimansaeure-(11)|8alpha-hydroxy-drimanoic acid|8alpha-hydroxydriman-11-oil acid|diaporol I
7-epi-11-hydroxychabrolidione A|rel-(2S,3S,6R)-6-(2-hydroxypropan-2-yl)-3-methyl-2-(3-oxobutyl)cycloheptanone
1beta,4alpha,7beta-trihydroxy-14beta-methyl-eudesman-11(12)-ene
1alpha,6beta,12-trihydroxy-1betaH,5alphaH,11H-guai-6(7)-ene
muurol-4-ene-1beta,3beta,10beta-triol|rel-(1R,4R,4aS,7R,8aS)-2,3,4,4a,7,8-hexahydro-1,6-dimethyl-4-(1-methylethyl)naphthalene-1,7,8a(1H)-triol
(3E,7E)-2,6,10-trimethyldodeca-3,7,11-triene-2,6,10-triol
4alpha,7beta,11-trihydroxy-1betaH,5alphaH-guai-10(14)-ene
rel-(3S,6R,7S,10S)-3,7,11-trimethyl-3,6;7,10-diepoxy-1-dodecen-11-ol
2,2,9-trimethyl-5-methylene-12-oxa-bicyclo[6.3.1]dodecane-4,9-diol
8alpha,9alpha-dihydroxypatchoulol|rel-(4S,6R,7R,8S,8aR)-octahydro-4,8a,9,9-tetramethyl-1,6-methanonaphthalene-1,7,8(2H)-triol
6,7,13-trihydroxy-3,4-dihydro-alpha-ylangene|dendronephthol B
2-[(2R,8R,8aS)-1,2,3,5,6,7,8,8a-octahydro-8,8a-dimethylnaphthalen-2-yl]propane-1,2,3-triol|eremophil-9-ene-11,12,13-triol
4beta,9beta,10alpha-trihydroxy-1alpha,5alpha-H-guaia-6-en
19-nor-dasycarpidan-1-one|Des-N-methyl-dasycarpidon|des-N-Methyl-dasycarpon|N-Nordasycarpidone.
1,15-Di-Ac-3-Hydroxymethyl-7,11-dimethyl-2,6-10-dodecatriene-1,5-diol
(E)-7alphaH-germacra-4,10(14)-diene-1beta,6alpha,11-triol
4alpha,5alpha-epoxy-6alpha-hydroxy amorphan-12-ol|4??,5??-Epoxy-6??-hydroxy amorphan-12-ol
2-[2-Oxo-3-(3-oxobutyl)-4-methylcyclohexyl]propanoic acid
(+)-(1R,5R,6R,7R,10R)-cadinan-4(11)-ene-1,5,12-triol
4alpha-hydroxygermacra-5E,10(14)-dien-1beta-hydroperoxide|nephtheoxydiol
(2S,4R,4aR,5R,7aS,4R)-(+)-4-epi-methylbotryodioxanenone
(E,1S,4S,7S,8S)-germacra-5,10(14)-dien-1,4,8-triol
3alpha,8alpha-dihydroxypatchoulol|rel-(3R,4R,6R,7S,8aS)-octahydro-4,8a,9,9-tetramethyl-1,6-methanonaphthalene-1,3,7(2H)-triol
rel-(1R,4S,6R,7S,8aR)-decahydro-1-(hydroxymethyl)-4,9,9-trimethyl- 4,7-(epoxymethano)azulen-6-ol
1,4-Dihydroxy-1,4a-dimethyl-7-[1-(hydroxymethyl)ethenyl]decahydronaphthalene
Spiro-6-(bicyclo[3.2.1]octane)-2-(oxirane), 7,8-di(hydroxymethyl)-5-methyl-2-isopropyl-
(1alpha,4beta,5beta,6beta,7beta,8beta)-10(14)-Guaiene-4,5,8-triol
Chrysanthemdiol A|rel-(2R,4aR,7S,8aR)-octahydro-7-(1-hydroxy-1-methylethyl)-4a-methyl-1-methylenenaphthalene-2,8a(1H)-diol
2beta,12-dihydroxypatchoulol|rel-(2R,4S,6R,8aS)-octahydro-4-(hydroxymethyl)-8a,9,9-trimethyl-1,6-methanonaphthalene-1,2(2H)-diol
(1alpha,10beta)-4-Muurolene-1,10,11-triol|eleganthol
C75
C75 is a synthetic fatty-acid synthase (FASN) inhibitor; inhibits prostate cancer cells PC3 with an IC50 of 35 μM[1][2][3]. C75 is a potent CPT1A activator[5].
(2R,3R,6R)-5-[(1E,3E)-hepta-1,3-dienyl]-2,3-dihydroxy-6-(hydroxymethyl)cyclohexan-1-one
(3E,5E)-2-(4-methoxy-4-oxobutyl)nona-3,5-dienoic acid
NPE_255.1491_11.6
CONFIDENCE Identification confirmed with Reference Standard synthesized at Eawag (Level 1); INTERNAL_ID 1106
NPE_255.1491_11.0
CONFIDENCE Tentative identification: most likely structure (Level 3); INTERNAL_ID 1107
C14H22O4_(2E)-2-(Hydroxymethyl)-3-[(1R,6R)-3-(hydroxymethyl)-6-isopropyl-2-cyclohexen-1-yl]acrylic acid
C14H22O4_3-Hydroxy-1a,5-bis(hydroxymethyl)-5,6b-dimethyloctahydrocyclopropa[e]inden-2(1H)-one
3-hydroxy-1a,5-bis(hydroxymethyl)-5,6b-dimethyl-1,3,3a,4,6,6a-hexahydrocyclopropa[e]inden-2-one
(E)-2-(hydroxymethyl)-3-[3-(hydroxymethyl)-6-propan-2-ylcyclohex-2-en-1-yl]prop-2-enoic acid
(2R,3R,6R)-5-[(1E,3E)-hepta-1,3-dienyl]-2,3-dihydroxy-6-(hydroxymethyl)cyclohexan-1-one
3-hydroxy-1a,5-bis(hydroxymethyl)-5,6b-dimethyl-1,3,3a,4,6,6a-hexahydrocyclopropa[e]inden-2-one_major
3-hydroxy-1a,5-bis(hydroxymethyl)-5,6b-dimethyl-1,3,3a,4,6,6a-hexahydrocyclopropa[e]inden-2-one_minor
(E)-2-(hydroxymethyl)-3-[3-(hydroxymethyl)-6-propan-2-ylcyclohex-2-en-1-yl]prop-2-enoic acid_major
(2R,3R,6R)-5-[(1E,3E)-hepta-1,3-dienyl]-2,3-dihydroxy-6-(hydroxymethyl)cyclohexan-1-one_major
trans-C75
trans-C75 ((±)-C75) is an enantiomer of C75. C75 is a synthetic fatty-acid synthase (FASN) inhibitor.
Setoclavine
8-Hydroxy-4(6)-lactarene-5,14-diol
(3beta,9beta)-7-Drimene-3,11,12-triol
7-Drimene-11,12,14-triol
19-nordehydro-4(18)-Abietene
4,4,5,5-Tetramethyl-2-(naphthalen-1-yl)-1,3,2-dioxaborolane
C16H19BO2 (254.14780240000002)
tert-butyl 2,9-diazaspiro[5.5]undecane-9-carboxylate
tert-butyl 4-(cyclopropanecarbonyl)piperazine-1-carboxylate
1-(3-ethoxy-3-oxopropyl)bicyclo[2.2.2]octane-4-carboxylic acid
1,8-Diazaspiro[5.5]undecan-8-carboxylic acid tert-butyl ester
1,9-Diazaspiro[5.5]undecan-1-carboxylic acid tert-butyl ester
4-(2-methoxyphenyl)-2,3,4,5-tetrahydro-1H-1,5-benzodiazepine
4-PYRROLIDIN-1-YL-PIPERIDINE-1-CARBOXYLIC ACIDTERT-BUTYL ESTER
tert-butyl N-[2-amino-2-(2-fluorophenyl)ethyl]carbamate
C13H19FN2O2 (254.14304860000001)
tert-butyl 1-oxo-2,8-diazaspiro[4.5]decane-8-carboxylate
tert-butyl octahydro-1h-pyrido[3,4-c]azepine-2(3h)-carboxylate
tert-butyl 2,8-diazaspiro[5.5]undecane-2-carboxylate
tert-butyl 1,8-diazaspiro[5.5]undecane-1-carboxylate
Decahydro-2,6-naphthalenedicarboxylic Acid Dimethyl Ester
butyl prop-2-enoate,prop-2-enyl 2-methylprop-2-enoate
tert-butyl 6-oxo-2,7-diazaspiro[4.5]decane-2-carboxylate
1,9-Diazaspiro[5.5]undecane-9-carboxylic acid, 1,1-dimethylethyl ester
4-Piperidinamine,N,N-dimethyl-1-(phenylmethyl)-, hydrochloride (1:2)
C14H23ClN2 (254.15496679999998)
ethyl 5-(2-hydroxybutan-2-yl)-2-propyl-1H-imidazole-4-carboxylate
(4-BUTYL[1,1-BIPHENYL]-4-YL)BORONIC ACID
C16H19BO2 (254.14780240000002)
1-(2,7-dihydroxy-3a-methyl-6-propan-2-yl-1,2,3,4,5,6,7,7a-octahydroinden-1-yl)ethanone
2-(4-METHYL-PIPERAZINE-1-CARBONYL)-CYCLOHEXANECARBOXYLIC ACID
4-(4-methoxyphenyl)-2,3,4,5-tetrahydro-1H-1,5-benzodiazepine
4-[(4-butylphenyl)hydrazinylidene]cyclohexa-2,5-dien-1-one
1,7-Diazaspiro[4.5]decane-1-carboxylic acid, 6-oxo-, 1,1-dimethylethyl ester
tert-butyl 2-oxo-1,8-diazaspiro[4.5]decane-8-carboxylate
ethyl 3-methyl-3-(4-oxopiperidin-1-yl)pyrrolidine-1-carboxylate
tert-Butyl 3-((dimethylamino)methylene)-4-oxopiperidine-1-carboxylate
3-CYCLOPROPYLAMINO-PIPERIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER
1H-1,4-Diazepine-1-carboxylic acid, 4-(cyclopropylmethyl)hexahydro-, 1,1-dimethylethyl ester
TERT-BUTYL (1-CYANO-3-CYCLOBUTYL-1-HYDROXYPROPAN-2-YL)CARBAMATE
tert-butyl 3-oxo-2,8-diazaspiro[4.5]decane-8-carboxylate
tert-butyl 2-(aminomethyl)-7-azaspiro[3.5]nonane-7-carboxylate
(1S,5R,6S)-Ethyl 5-(pentan-3-yl-oxy)-7-oxa-bicyclo[4.1.0]hept-3-ene-3-carboxylate
2-Amino-5-methylthiophene-3-carbonitrile
C13H19FN2O2 (254.14304860000001)
tert-Butyl 1,8-diazaspiro[4.6]undecane-1-carboxylate
ETHYL 4-(2-METHOXYPROPAN-2-YL)-2-PROPYL-1H-IMIDAZOLE-5-CARBOXYLATE
(trans,trans)-[1,1-Bicyclohexyl]-4,4-dicarboxylic acid
tert-butyl 8-amino-2-azaspiro[4.5]decane-2-carboxylate
tert-butyl exo-3-(methylamino)-9-azabicyclo[3.3.1]nonane-9-carboxylate
tert-butyl 3,9-diazaspiro[5.5]undecane-3-carboxylate
tert-butyl 2,9-diazaspiro[5.5]undecane-2-carboxylate
Naphthalene-2-boronic acid pinacol ester
C16H19BO2 (254.14780240000002)
1,2-bis(ethenyl)benzene,2-methylbuta-1,3-diene,2-methylprop-1-ene
13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-one
1-(1-Hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)pyrrolidine-2,5-dione
2-(Hydroxymethyl)-3-[3-(hydroxymethyl)-6-propan-2-ylcyclohex-2-en-1-yl]prop-2-enoic acid
2-({2-[Dimethyl(2-phosphanylethyl)ammonio]ethyl}dimethylammonio)ethyl phosphinite
(1S,2R,5R,7R,9S,11R)-2,6,6,9-tetramethyltricyclo[5.4.0.02,9]undecane-5,8,11-triol
2-{[(4-Methoxybenzyl)(methyl)amino]methyl}-2-methylpropane-1,3-diol
C14H24NO3+ (254.17560939999998)
Phenbenzamine
D018377 - Neurotransmitter Agents > D018490 - Serotonin Agents > D012702 - Serotonin Antagonists D018377 - Neurotransmitter Agents > D018494 - Histamine Agents > D006633 - Histamine Antagonists D003879 - Dermatologic Agents > D000982 - Antipruritics D005765 - Gastrointestinal Agents D018926 - Anti-Allergic Agents
7,7-Dimethyl-1-[2-(4-methylphenyl)ethenyl]bicyclo[2.2.1]heptan-2-one
3-Deoxyestrone
D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones
(2S,3R)-4-methylidene-2-octyl-5-oxooxolane-3-carboxylic acid
Aspergillide A
A macrolide that is 4,15-dioxabicyclo[9.3.1]pentadec-9-en-3-one substituted by a hydroxy group at position 14 and a methyl group at position 5 (the 1R,5S,9E,11R,14S stereoisomer). It is isolated from the marine-derived fungus Aspergillus ostianus and exhibits cytotoxic activity against mouse lymphocytic leukemia cells (L1210).
Merulin A, (rel)-
D009676 - Noxae > D016877 - Oxidants > D010545 - Peroxides A natural product found in Endophytic fungi.
rel-(1R,2S,5R,6R,7R,8R)-5-isopropyl-2,8-dimethyl-11-oxatricyclo[5.3.1.0(2,6)]undecane-1,8-diol
(2S)-4-methylidene-2-octyl-5-oxooxolane-3-carboxylic acid
(3E,5E)-2-(4-Methoxy-4-oxobutyl)nona-3,5-dienoic acid
4-Ethyl-14-methyl-1,4-diazatetracyclo[7.6.1.05,16.010,15]hexadeca-9(16),10,12,14-tetraene
4,6-dimethyl-N-[(E)-1-(2-methylphenyl)ethylideneamino]pyrimidin-2-amine
(1alpha,5alpha)-8alpha-(3-Hydroxy-1-methoxy-1-methylpropyl)-6,6-dimethylbicyclo[3.3.0]octan-2-one
(3S,4R,5S)-4-(tert-Butyldimethylsilyloxy)-3,5-dimethyl-1-heptyne
C15H30OSi (254.20658099999997)
(Z)-3-Methyl-4-(1-methoxycyclohexyl)-2-butenyltrimethylsilane
C15H30OSi (254.20658099999997)
Methyl 8,8-ethylenedioxy-4,4-dimethyl-1alpha,5alpha-bicyclo(3.3.0)octane-2beta-carboxylate
(3-Methylene-5-oxo-2-propionylheptyl)trimethylsilane
3-(Methoxycarbonyl)-6-isopropyloctahydro-2H-cyclohepta[b]furan-2-one
8alpha-(3-Hydroxy-1-methoxy-1-methyl)propyl-6,6-dimethyl-1alpha,5alpha-bicyclo(3.3.0)octan-2-one
(-)-homalomenol C
An organic heterotricyclic compound and sesquiterpenoid that is 11-oxatricyclo[5.3.1.0(2,6)]undecane-1,8-diol which is substituted by methyl groups at positions 5 and 8, and by an isopropyl group at position 5. The absolute stereochemistry is not known; it is either 1R,2S,5R,6R,7R,8R (as shown), or the enantiomer.
1-(hydroxymethyl)-5,5,8a-trimethyl-hexahydro-1h-spiro[naphthalene-2,2'-oxiran]-6-ol
(1s,6r,9s,10r)-10-hydroxy-2,2,6-trimethyl-7,8-dioxatricyclo[7.3.1.0¹,⁶]tridecan-5-one
(1s,5r,11r,14s)-14-hydroxy-5-methyl-4,15-dioxabicyclo[9.3.1]pentadec-9-en-3-one
[(1s,4ar,5r,8ar)-5,6-bis(hydroxymethyl)-1,4a-dimethyl-2,3,4,5,8,8a-hexahydronaphthalen-1-yl]methanol
(2r,4ar,7s,8ar)-7-(2-hydroxypropan-2-yl)-4a-methyl-1-methylidene-hexahydro-2h-naphthalene-2,7-diol
(1s,2r,3ar,4s,8as)-1-isopropyl-3a,6-dimethyl-2,3,4,7,8,8a-hexahydroazulene-1,2,4-triol
(3e,6e,8r,10r)-2,6,10-trimethyldodeca-3,6,11-triene-2,8,10-triol
(3r,5s,6e,9s)-3,7,11-trimethyldodeca-1,6,10-triene-3,5,9-triol
(3e)-2,10-dihydroxy-2,6,10-trimethyldodeca-3,11-dien-5-one
(1s,3s,5s,6r,8as)-6-isopropyl-4,8a-dimethyl-2,3,5,6,7,8-hexahydro-1h-naphthalene-1,3,5-triol
(1s,2s,3s,5r,6r,8s)-1,5,9,9-tetramethyl-10-oxatricyclo[6.2.2.0²,⁶]dodecane-3,8-diol
6-hydroxy-2,6-dimethylocta-2,7-dien-1-yl 3-methylbutanoate
(1s,3ar,4r,8as)-4-(hydroxymethyl)-7-isopropyl-1-methyl-2,3,3a,5,6,8a-hexahydroazulene-1,4-diol
3-(hydroxymethyl)-6,6,7b-trimethyl-octahydro-1h-cyclobuta[e]indene-1,4-diol
(5r)-5-[(1s,2r,3s,5s,6s)-2,3-dihydroxy-2-methylbicyclo[3.1.0]hexan-6-yl]-6-methylheptan-2-one
(1r,2r,4ar,5r,8as)-2-isopropyl-4a-methyl-8-methylidene-hexahydro-1h-naphthalene-1,2,5-triol
1a-isopropyl-4,7-dimethyl-hexahydro-2h-azuleno[4,5-b]oxirene-4,7-diol
1,5,8,9-tetramethyl-12-oxatricyclo[6.3.1.0²,⁶]dodecane-5,7-diol
(1s,3ar,4s,8as)-4-(hydroxymethyl)-7-isopropyl-1-methyl-2,3,3a,5,6,8a-hexahydroazulene-1,4-diol
4-hydroxy-6-(2-hydroxypropan-2-yl)-4,8a-dimethyl-hexahydro-2h-naphthalen-1-one
2,3,10,10-tetramethyltricyclo[6.3.0.0²,⁶]undecane-4,6,8-triol
1,7-bis(hydroxymethyl)-1,4-dimethyl-octahydro-1ah-cyclopropa[e]azulen-4-ol
(1r,2s,3as,8ar)-6-(hydroxymethyl)-1-isopropyl-3a-methyl-2,3,4,7,8,8a-hexahydroazulene-1,2-diol
(1s,2r,4as,5s,8ar)-1,5-bis(hydroxymethyl)-1,4a,6-trimethyl-2,3,4,5,8,8a-hexahydronaphthalen-2-ol
2,6,6,9-tetramethyltricyclo[5.4.0.0²,⁹]undecane-5,8,11-triol
8-isopropyl-1,5-dimethyl-11-oxatricyclo[6.2.1.0²,⁶]undecane-5,7-diol
5-(3-hydroxy-2,2-dimethyl-6-methylidenecyclohexyl)-3-methylpentanoic acid
(3z,4s,5r)-3-decylidene-4-hydroxy-5-methyloxolan-2-one
1,4-bis(hydroxymethyl)-1,7-dimethyl-octahydro-1ah-cyclopropa[e]azulen-4-ol
(1s,3as,4r,7s)-7-isopropyl-1,4-dimethyl-3,4,5,6-tetrahydro-2h-azulene-1,3a,7-triol
2,3,10,10-tetramethyltricyclo[6.3.0.0²,⁶]undecane-4,6,7-triol
(1r,2r,5s,6r,7s,8s,9s)-1,5,8,9-tetramethyl-12-oxatricyclo[6.3.1.0²,⁶]dodecane-5,7-diol
8-(carboxymethyl)-2,6,6-trimethylbicyclo[3.2.1]octane-1-carboxylic acid
1,2-bis(hydroxymethyl)-6,8a-dimethyl-5-methylidene-hexahydro-1h-naphthalen-2-ol
3a-(hydroxymethyl)-6-(2-hydroxypropan-2-yl)-8a-methyl-hexahydro-1h-azulen-4-one
5-hydroperoxy-6-methyl-2-(4-methylcyclohex-3-en-1-yl)hept-6-en-2-ol
(2r)-2-[(2r,4ar,8ar)-8a-hydroxy-4a-methyl-8-methylidene-hexahydro-1h-naphthalen-2-yl]propane-1,2-diol
5-isopropyl-8-methyl-3-methylidene-hexahydro-1h-azulene-4,5,8-triol
6-(5-hydroxy-5-methylhexyl)-4-methoxy-3-methylpyran-2-one
4-hydroxy-6-[(6s)-6-hydroxy-5-methylheptyl]-3-methylpyran-2-one
(2s,6e,9r)-9-(hydroxymethyl)-2,6,10-trimethylundeca-6,10-dienoic acid
(1r,2r,3s,5s,6e,10s)-3-isopropyl-6,10-dimethyl-11-oxabicyclo[8.1.0]undec-6-ene-2,5-diol
(2e,6z,10e)-6-(hydroxymethyl)-2,10-dimethyldodeca-2,6,10-triene-1,12-diol
(1r,3s,4as,6r,8ar)-6-(2-hydroxypropan-2-yl)-8a-methyl-4-methylidene-octahydronaphthalene-1,3-diol
8-(2-hydroxypropan-2-yl)-1,5-dimethyl-11-oxatricyclo[6.2.1.0²,⁶]undecan-5-ol
(1r,2as,3r,4s,4ar,7as,7br)-3-(hydroxymethyl)-6,6,7b-trimethyl-octahydro-1h-cyclobuta[e]indene-1,4-diol
(1r,2z,4r,5r,7e)-7-(hydroxymethyl)-4-isopropyl-1-methylcyclodeca-2,7-diene-1,5-diol
5-[(1r,3s)-3-hydroxy-2,2-dimethyl-6-methylidenecyclohexyl]-3-methylpentanoic acid
(5s,6s,8s,8as)-4,5-bis(hydroxymethyl)-2,2,8-trimethyl-3,5,6,7,8,8a-hexahydro-1h-azulen-6-ol
2-[5-(hydroxymethyl)-8-methyl-1,2,3,4,4a,5,6,7-octahydronaphthalen-2-yl]propane-1,3-diol
1-[7-(hydroxymethyl)-4-isopropyl-1-methylbicyclo[3.2.1]oct-6-en-8-yl]ethane-1,2-diol
6-(hydroxymethyl)-2,2,8-trimethyltricyclo[5.3.1.0³,⁸]undecane-3,4-diol
(2r)-2-[(2s,3r,8r,8ar)-3-hydroxy-8,8a-dimethyl-2,3,5,6,7,8-hexahydro-1h-naphthalen-2-yl]propane-1,2-diol
10-hydroxy-2,2,6-trimethyl-7,8-dioxatricyclo[7.3.1.0¹,⁶]tridecan-5-one
1,1,4,7-tetramethyl-octahydrocyclopropa[e]azulene-4,6,7-triol
(1r,2r,3s,6r,7r,8s,10s)-10-isopropyl-3,7-dimethyl-11-oxatricyclo[5.3.1.0²,⁶]undecane-3,8-diol
(3e,4s,5r)-3-decylidene-4-hydroxy-5-methyloxolan-2-one
(3ar,4r,7s,8s)-7,8-bis(hydroxymethyl)-2,2,4-trimethyl-3,3a,5,6,7,8-hexahydroazulen-4-ol
(1s,2s,5r,7r,8r,9s,11r)-2,6,6,9-tetramethyltricyclo[5.4.0.0²,⁹]undecane-5,8,11-triol
2,10-dihydroxy-2,6,10-trimethyldodeca-3,11-dien-5-one
(3s,5e)-6-[(2r,5r)-5-(2-hydroxypropan-2-yl)-2-methyloxolan-2-yl]-3-methylhexa-1,5-dien-3-ol
(1r,2s,4s,8s,9e)-8-isopropyl-1-methyl-5-methylidenecyclodec-9-ene-1,2,4-triol
(2r,3r,4s,4ar,8ar)-2-hydroxy-4-(hydroxymethyl)-3,4a,8,8-tetramethyl-hexahydro-2h-naphthalen-1-one
(5s)-5-[(1s,2r,3s,5s,6s)-2,3-dihydroxy-2-methylbicyclo[3.1.0]hexan-6-yl]-6-methylheptan-2-one
2-[(2r,4as,8as)-8a-hydroperoxy-4a-methyl-8-methylidene-hexahydro-1h-naphthalen-2-yl]propan-2-ol
(1r,2r,4as,7r,8ar)-2-(2-hydroxypropan-2-yl)-4a-methyl-8-methylidene-octahydronaphthalene-1,7-diol
(3s,6r)-8-chloro-1,1,9-trimethyl-5-methylidenespiro[5.5]undec-8-en-3-ol
C15H23ClO (254.14373379999998)