Exact Mass: 236.14123700000002
Exact Mass Matches: 236.14123700000002
Found 500 metabolites which its exact mass value is equals to given mass value 236.14123700000002,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
CARBETAMIDE
CONFIDENCE standard compound; INTERNAL_ID 383; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3778; ORIGINAL_PRECURSOR_SCAN_NO 3775 CONFIDENCE standard compound; INTERNAL_ID 383; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3852; ORIGINAL_PRECURSOR_SCAN_NO 3849 CONFIDENCE standard compound; INTERNAL_ID 383; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3781; ORIGINAL_PRECURSOR_SCAN_NO 3776 CONFIDENCE standard compound; INTERNAL_ID 383; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7762; ORIGINAL_PRECURSOR_SCAN_NO 7757 DATA_PROCESSING MERGING RMBmix ver. 0.2.7; CONFIDENCE standard compound; INTERNAL_ID 383; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7762; ORIGINAL_PRECURSOR_SCAN_NO 7757 CONFIDENCE standard compound; INTERNAL_ID 383; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7771; ORIGINAL_PRECURSOR_SCAN_NO 7769 CONFIDENCE standard compound; INTERNAL_ID 383; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7800; ORIGINAL_PRECURSOR_SCAN_NO 7797 CONFIDENCE standard compound; INTERNAL_ID 383; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7804; ORIGINAL_PRECURSOR_SCAN_NO 7802 CONFIDENCE standard compound; INTERNAL_ID 383; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7791; ORIGINAL_PRECURSOR_SCAN_NO 7787 CONFIDENCE standard compound; INTERNAL_ID 383; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7811; ORIGINAL_PRECURSOR_SCAN_NO 7809 ORIGINAL_ACQUISITION_NO 7811; CONFIDENCE standard compound; INTERNAL_ID 383; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_PRECURSOR_SCAN_NO 7809 CONFIDENCE standard compound; EAWAG_UCHEM_ID 136
Hexobarbital
Hexobarbital is only found in individuals that have used or taken this drug. It is a barbiturate that is effective as a hypnotic and sedative. [PubChem]Hexobarbital binds at a distinct binding site associated with a Cl- ionopore at the GABA-A receptor, increasing the duration of time for which the Cl- ionopore is open. The post-synaptic inhibitory effect of GABA in the thalamus is, therefore, prolonged. D002491 - Central Nervous System Agents > D002492 - Central Nervous System Depressants > D006993 - Hypnotics and Sedatives N - Nervous system > N05 - Psycholeptics > N05C - Hypnotics and sedatives > N05CA - Barbiturates, plain N - Nervous system > N01 - Anesthetics > N01A - Anesthetics, general > N01AF - Barbiturates, plain C78272 - Agent Affecting Nervous System > C29756 - Sedative and Hypnotic > C67084 - Barbiturate D018377 - Neurotransmitter Agents > D018682 - GABA Agents > D018757 - GABA Modulators
Procaine
C13H20N2O2 (236.15247000000002)
Procaine is only found in individuals that have used or taken this drug. It is a local anesthetic of the ester type that has a slow onset and a short duration of action. It is mainly used for infiltration anesthesia, peripheral nerve block, and spinal block. (From Martindale, The Extra Pharmacopoeia, 30th ed, p1016). [PubChem]Procaine acts mainly by inhibiting sodium influx through voltage gated sodium channels in the neuronal cell membrane of peripheral nerves. When the influx of sodium is interrupted, an action potential cannot arise and signal conduction is thus inhibited. The receptor site is thought to be located at the cytoplasmic (inner) portion of the sodium channel. Procaine has also been shown to bind or antagonize the function of N-methyl-D-aspartate (NMDA) receptors as well as nicotinic acetylcholine receptors and the serotonin receptor-ion channel complex. Procaine is a local anesthetic drug of the amino ester group. It is used primarily to reduce the pain of intramuscular injection of penicillin, and it is also used in dentistry. Owing to the ubiquity of the trade name Novocain, procaine is sometimes referred to generically as novocaine. It acts mainly by being a sodium channel blocker. C - Cardiovascular system > C05 - Vasoprotectives > C05A - Agents for treatment of hemorrhoids and anal fissures for topical use > C05AD - Local anesthetics D002491 - Central Nervous System Agents > D002492 - Central Nervous System Depressants > D000777 - Anesthetics N - Nervous system > N01 - Anesthetics > N01B - Anesthetics, local > N01BA - Esters of aminobenzoic acid S - Sensory organs > S01 - Ophthalmologicals > S01H - Local anesthetics > S01HA - Local anesthetics D018373 - Peripheral Nervous System Agents > D018689 - Sensory System Agents C78272 - Agent Affecting Nervous System > C245 - Anesthetic Agent KEIO_ID P190; [MS2] KO009161 KEIO_ID P190
OCTAMETHYLTRISILOXANE
C8H24O2Si3 (236.10840439999998)
P - Antiparasitic products, insecticides and repellents > P03 - Ectoparasiticides, incl. scabicides, insecticides and repellents > P03A - Ectoparasiticides, incl. scabicides D001697 - Biomedical and Dental Materials
Heptyl 4-hydroxybenzoate
Heptyl 4-hydroxybenzoate, also known as heptylparaben or nipaheptyl, belongs to the class of organic compounds known as p-hydroxybenzoic acid alkyl esters. These are aromatic compounds containing a benzoic acid, which is esterified with an alkyl group and para-substituted with a hydroxyl group. Heptyl 4-hydroxybenzoate is used as a food additive ("EAFUS: Everything Added to Food in the United States. "). Heptyl 4-hydroxybenzoate is a potentially toxic compound. No indication of carcinogenicity to humans (not listed by IARC). These are compounds containing an hydroxybenzoic acid (or a derivative), which is a benzene ring bearing a carboxylic acid. It is used as a food additive . CONFIDENCE standard compound; INTERNAL_ID 575; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5546; ORIGINAL_PRECURSOR_SCAN_NO 5541 CONFIDENCE standard compound; INTERNAL_ID 575; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5537; ORIGINAL_PRECURSOR_SCAN_NO 5532 CONFIDENCE standard compound; INTERNAL_ID 575; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5548; ORIGINAL_PRECURSOR_SCAN_NO 5545 CONFIDENCE standard compound; INTERNAL_ID 575; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5514; ORIGINAL_PRECURSOR_SCAN_NO 5512 CONFIDENCE standard compound; INTERNAL_ID 575; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5543; ORIGINAL_PRECURSOR_SCAN_NO 5539 CONFIDENCE standard compound; INTERNAL_ID 575; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5543; ORIGINAL_PRECURSOR_SCAN_NO 5540 D010592 - Pharmaceutic Aids > D011310 - Preservatives, Pharmaceutical > D010226 - Parabens It is used as a food additive .
METABUTETHAMINE
C13H20N2O2 (236.15247000000002)
N - Nervous system > N01 - Anesthetics > N01B - Anesthetics, local > N01BA - Esters of aminobenzoic acid C78272 - Agent Affecting Nervous System > C245 - Anesthetic Agent
Alanylphenylalanine
Alanylphenylalanine is a dipeptide composed of alanine and phenylalanine. It is an incomplete breakdown product of protein digestion or protein catabolism. Some dipeptides are known to have physiological or cell-signaling effects although most are simply short-lived intermediates on their way to specific amino acid degradation pathways following further proteolysis.
Mintsulfide
Mintsulfide is found in herbs and spices. Mintsulfide is a constituent of Mentha piperita oil. Constituent of Mentha piperita oil. Mintsulfide is found in herbs and spices.
Eremopetasidione
Eremopetasidione is found in green vegetables. Eremopetasidione is a constituent of Petasites japonicus (sweet coltsfoot). Constituent of Petasites japonicus (sweet coltsfoot). Eremopetasidione is found in green vegetables.
Phenylalanylalanine
Phenylalanylalanine is a dipeptide composed of phenylalanine and alanine. It is an incomplete breakdown product of protein digestion or protein catabolism. Dipeptides are organic compounds containing a sequence of exactly two alpha-amino acids joined by a peptide bond. Some dipeptides are known to have physiological or cell-signalling effects although most are simply short-lived intermediates on their way to specific amino acid degradation pathways following further proteolysis. Phenylalanylalanine (H-Phe-Ala-OH) is a dipeptide composed of phenylalanine and alanine. Phenylalanylalanine is an incomplete breakdown product of protein digestion or protein catabolism[1].
1,5,5,8-Tetramethyl-12-thiabicyclo[9.1.0]dodeca-3,7-diene
1,5,5,8-Tetramethyl-12-thiabicyclo[9.1.0]dodeca-3,7-diene is a constituent of hops. Constituent of hops
3,7,7,10-Tetramethyl-12-thiabicyclo[9.1.0]dodeca-3,7-diene
3,7,7,10-Tetramethyl-12-thiabicyclo[9.1.0]dodeca-3,7-diene is a constituent of hops. Constituent of hops
O-Desmethyl-lacosamide
O-Desmethyl-lacosamide is a metabolite of lacosamide. Lacosamide (formerly known as erlosamide) is a medication developed by UCB for the adjunctive treatment of partial-onset seizures and diabetic neuropathic pain marketed under the trade name Vimpat. The U.S. Food and Drug Administration accepted UCBs New Drug Application for lacosamide as of November 29, 2007, beginning the approval process for the drug. (Wikipedia)
N-Acetyl-5-methoxykynuramine
N-Acetyl-5-methoxykynuramine (AMK) is a melatonin metabolite. Its direct precursor, acetyl-N-formyl-5-methoxykynurenamine (AFMK), is a product of melatonin metabolization in the brain (PMID: 23963910). AMK is a potent scavenger of several reactive oxygen species (ROS) such as hydroxyl, peroxyl, and carbonate radicals as well as the non-radical singlet oxygen (PMID: 14599344, 18643875).
Cyclobarbital
N - Nervous system > N05 - Psycholeptics > N05C - Hypnotics and sedatives > N05CA - Barbiturates, plain C78272 - Agent Affecting Nervous System > C29756 - Sedative and Hypnotic
Dropropizine
C13H20N2O2 (236.15247000000002)
R - Respiratory system > R05 - Cough and cold preparations > R05D - Cough suppressants, excl. combinations with expectorants C78272 - Agent Affecting Nervous System > C29698 - Antispasmodic Agent D019141 - Respiratory System Agents > D000996 - Antitussive Agents D002491 - Central Nervous System Agents
Oxyglutinosone
Oxyglutinosone is a member of the class of compounds known as cyclohexenones. Cyclohexenones are compounds containing a cylohexenone moiety, which is a six-membered aliphatic ring that carries a ketone and has one endocyclic double bond. Oxyglutinosone is slightly soluble (in water) and a very weakly acidic compound (based on its pKa). Oxyglutinosone can be found in potato, which makes oxyglutinosone a potential biomarker for the consumption of this food product.
Oxyglutinosone
2-[4-Methyl-2-(2-methylpropoxy)phenyl]-oxiranemethanol
dropropizine
C13H20N2O2 (236.15247000000002)
R - Respiratory system > R05 - Cough and cold preparations > R05D - Cough suppressants, excl. combinations with expectorants C78272 - Agent Affecting Nervous System > C29698 - Antispasmodic Agent D019141 - Respiratory System Agents > D000996 - Antitussive Agents D002491 - Central Nervous System Agents CONFIDENCE standard compound; EAWAG_UCHEM_ID 3307
3-morpholino-4-tetrahydro-1h-pyrrol-1-ylcyclobut-3-ene-1,2-dione
9beta-hydroxy-8-oxo-12-noreremophil-6-en-11-one|rel-(1R,4aS,5S)-3-acetyl-4a,5,6,7,8,8a-hexahydro-1-hydroxy-4a,5-dimethylnaphthalen-2(1H)-one
Dimethyl-trans-3-octenyl-phosphat|phosphoric acid dimethyl ester oct-3t-enyl ester
6alpha-acetyl-4beta,5beta-dimethyl-1(10)-ene-2alpha-hydroxy-7-oxodecalin|laevinol E
Pyridine, 1-acetyl-5-(1-formyl-2-piperidinyl)-1,2,3,4-tetrahydro-
C13H20N2O2 (236.15247000000002)
4-(1-hydroxy-4,7-dimethyl-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-3-yl)but-3-en-2-one
(1beta,11?鈥?-form-1,11-Dihydroxy-13-nor-6,9-eremophiladien-8-one|1beta-hydroxy-6,9-diene-8-oxo-11-nor-11-hydroxyeremophilane
1-(3-(1-Hydroxy-3-methylbutyl)-4-methoxyphenyl)ethan-1-one
(3aR,5aR,7S,9aS,9bR)-3a,5a,7,8,9,9a,9b-octahydro-3a,7-dihydroxy-7,9b-dimethhylnaphtho[1,2-c]furan-1(3H)-one|(?)-oblongolide C|oblongolide C
3beta,4alpha,9-trihydroxy-14-norcadina-5,7,9-triene|oxyphyllenotriol A
1,5-epidioxy-14-norcarot-2-en-3-one|1,5-epidioxy-14-norcarot-2-en-4-one
1beta-hydroxyl-2-noreudesm-4(15)-en-5alpha,6beta,7alpha,11alphaH-12,6-olide|ajaniaolide A
11beta-hydroxyl-3-oxo-4(5),6(7)-diene-eudesman-12-ol
(S)-dihydrodemethoxywutaiensol|3-[(2S)-2,3-dihydro-2-(2-hydroxypropan-2-yl)-1-benzofuran-5-yl]propan-1-ol
(3R,4S)-6,8-dihydroxy-1,1-dimethyl-3,4,5-trimethylisochroman
(5R,7S,10S)-5-hydroxy-13-noreudesma-3-en-2,11-dione
2-(4-methoxyphenyl)-ethylisovalerate|2-<4-methoxyphenyl>-ethylisovalerate
(3aS,5aR,7S,9aS,9bR)-7-(hydroxymethyl)-9b-methyl-3a,5a,6,7,8,9,9a,9b-octahydronaphtho[1,2-c]furan-1(9bH)-one|oblongolide F
5alpha,8alpha-epidioxy-6-eudesmene|eudesm-6-ene-5alpha,8beta-endoepoxide
(E)-3-<1-(1,1-dimethyl-3-oxobutyl)imidazol-4-yl>propenoic acid|(E)-3-[1-(1,1-dimethyl-3-oxobutyl)imidazol-4-yl]propenoic acid|N1-(1,1-Dimethyl-3-oxobutyl)-(E)-Urocanic acid
(1S*,6R*,7R*,10R*)-7-hydroxycadin-4-en-3-one|(7??, 10??)-form-7-Hydroxy-4-amorphen-3-one
(-)-(1R,3R,6S,7S,8S)-3-hydroxy-2,2,6,8-tetramethyltricyclo[5.3.1.03,8]undecan-10-one|(6S,7S,8S)-3-hydroxy-2,2,6,8-tetramethyltricyclo[5.3.1.03,8]undecan-10-one|valeriananoid A
(2S,3R,7S)-[2,3:7,13]-diepoxy-trans-himachalane|2alpha,3alpha:7beta,13beta-diepoxy-trans-himachalane|beta-himachalene
4,5-seco-african-4,5-dione|8,9-secoafricanane-8,9-dione
(1E,4E,6R,9S)-4,11,11-trimethyl-8-methylene-1,4-cycloundecadiene-6,9-diol
(E)-form-12-Tetradecene-8,10-diyne-1,3,14-triol,|Tetradeca-2t-en-4,6-diin-1,12,14-triol
6beta-hydroxy-(7alphaH)-eudesm-4-en-3-one|6beta-hydroxy-7alpha(H)-eudesm-4-en-3-one
12-Tetradecene-8,10-diyne-1,4,5-triol|tetradeca-12t-ene-8,10-diyne-1,4,5-triol
4a-Hydroxy-6-isopropenyl-4,8a-dimethyloctahydro-1(2H)-naphthalenone #
(3aS,5aR,7R,9aS,9bR)-3a,5a,6,7,8,9,9a,9b-octahydro-7-hydroxy-7,9b-dimethylnaphtho[1,2-c]furan-1(3H)-one|oblongolide D
(4alpha,5alpha,8beta)-8-Hydroxy-11-eremophilen-2-one|8beta-Hydroxy-4betaH,10betaH-5alpha-eremophil-11-en-2-on (Tsuwabukinonol)
1alpha,10alpha-Epoxide-1(10),4(15)-Lepidozadien-5-ol
3,6-Epoxy-3-methyl-7-methylene-10-isopropylcyclodecan-1-one
1-n-butyl-1beta-D-fructopyranoside|1-O-butyl-beta-D-fructopyranoside
(3E)-dec-3-en-1-yl sulfate|ammonium dec-3-enyl sulfate
2-Hepten-4-one, 6-hydroxy-2-methyl-6-(4-methyl-3-cyclohexen-1-yl)-
15-hydroxy-6alpha,12-epoxy-7beta,10alphaH,11betaH-spiroax-4-ene
(2E,6E)-3-isopropyl-6-methyl-10-oxoundeca-2,6-dienal
(E)-form-6-Tetradecene-8,10-diyne-1,5,12-triol|tetradec-6t-ene-8,10-diyne-1,5,12-triol|Tetradec-trans-6-en-8.10-diin-1.5.12-triol
3-Hydroxy-4-gymnomitranone|8beta-Hydroxy-gymnomitran-9-one|8??-Hydroxy gymnomitrian-9-one
Dihydrocurcumenone
4β,12-Dihydroxyguaian-6,10-diene
Bisabolone oxide A
[S-(R*,R*)]-dihydro-2,2,6-trimethyl-6-(4-methyl-3-cyclohexen-1-yl)-2H-pyran-3(4H)-one is a natural product found in Matricaria chamomilla with data available.
1-[3-(1-hydroxy-3-methylbutyl)-4-methoxyphenyl]ethanone
Butyl fructofuranoside
Butyl fructofuranoside is a natural product found in Ophiopogon japonicus, Dioscorea japonica, and Cynomorium songaricum with data available.
Dexmedetomidine hydrochloride
D002491 - Central Nervous System Agents > D002492 - Central Nervous System Depressants > D006993 - Hypnotics and Sedatives C78272 - Agent Affecting Nervous System > C29747 - Adrenergic Agent > C87053 - Adrenergic Agonist D018377 - Neurotransmitter Agents > D018663 - Adrenergic Agents > D000322 - Adrenergic Agonists D018373 - Peripheral Nervous System Agents > D018689 - Sensory System Agents D002491 - Central Nervous System Agents > D000700 - Analgesics Dexmedetomidine hydrochloride ((+)-Medetomidine hydrochloride) is a potent, selective and orally active agonist of α2-adrenoceptor, with a Ki of 1.08 nM. Dexmedetomidine hydrochloride shows 1620-fold selectivity against α1-adrenoceptor. Dexmedetomidine hydrochloride exhibits anxiolysis, sedation, and modest analgesia effects[1][2][3].
Medetomidine HCl
D002491 - Central Nervous System Agents > D002492 - Central Nervous System Depressants > D006993 - Hypnotics and Sedatives C78272 - Agent Affecting Nervous System > C29747 - Adrenergic Agent > C87053 - Adrenergic Agonist D018377 - Neurotransmitter Agents > D018663 - Adrenergic Agents > D000322 - Adrenergic Agonists D018373 - Peripheral Nervous System Agents > D018689 - Sensory System Agents D002491 - Central Nervous System Agents > D000700 - Analgesics Medetomidine hydrochloride is an orally active α2-adrenoceptor agonist (Ki: 1.08 nM). Medetomidine hydrochloride has sedative and analgesic effects. Medetomidine hydrochloride can cause peripheral vasoconstriction through the activation of α2 adrenoceptors on blood vessels[1][2][3][4].
C15H24O2_2(1H)-Naphthalenone, 4a,5,6,7,8,8a-hexahydro-6-hydroxy-3,8-dimethyl-5-(1-methylethyl)-, (4aR,5S,6S,8R,8aS)
C15H24O2_(4S,4aR)-4-(Hydroxymethyl)-3,4a,8,8-tetramethyl-4a,5,6,7,8,8a-hexahydro-1(4H)-naphthalenone
(4aR,5S,6S,8R,8aS)-6-hydroxy-3,8-dimethyl-5-propan-2-yl-4a,5,6,7,8,8a-hexahydro-1H-naphthalen-2-one
Ala-Phe
A dipeptide formed from L-alanyl and L-phenylalanine residues. CONFIDENCE standard compound; INTERNAL_ID 165
procaine
C13H20N2O2 (236.15247000000002)
C - Cardiovascular system > C05 - Vasoprotectives > C05A - Agents for treatment of hemorrhoids and anal fissures for topical use > C05AD - Local anesthetics D002491 - Central Nervous System Agents > D002492 - Central Nervous System Depressants > D000777 - Anesthetics N - Nervous system > N01 - Anesthetics > N01B - Anesthetics, local > N01BA - Esters of aminobenzoic acid S - Sensory organs > S01 - Ophthalmologicals > S01H - Local anesthetics > S01HA - Local anesthetics D018373 - Peripheral Nervous System Agents > D018689 - Sensory System Agents C78272 - Agent Affecting Nervous System > C245 - Anesthetic Agent Annotation level-1
(-)-Curcumol
[Raw Data] CBA93_(-)-Curcumol_pos_50eV.txt [Raw Data] CBA93_(-)-Curcumol_pos_40eV.txt [Raw Data] CBA93_(-)-Curcumol_pos_30eV.txt [Raw Data] CBA93_(-)-Curcumol_pos_20eV.txt [Raw Data] CBA93_(-)-Curcumol_pos_10eV.txt
Phe-Ala
A dipeptide formed from L-phenylalanine and L-alanine residues. Phenylalanylalanine (H-Phe-Ala-OH) is a dipeptide composed of phenylalanine and alanine. Phenylalanylalanine is an incomplete breakdown product of protein digestion or protein catabolism[1].
(2E,6E)-1-Hydroxy-2,6,10-farnesatrien-9-one
Petrovin B
4a,5a-Epoxy-11-eudesmen-3a-ol
Aubergenone
1,5,5,8-Tetramethyl-12-thiabicyclo[9.1.0]dodeca-3,7-diene
3,7,7,10-Tetramethyl-12-thiabicyclo[9.1.0]dodeca-3,7-diene
12,13-Dimethyl-5,14-dioxabicyclo[9.2.1]-tetradeca-1(13),11-dien-4-one
2,6-bis(2-hydroxyethylamino)-4-methylpyridine-3-carbonitrile
Levodropropizine
C13H20N2O2 (236.15247000000002)
R - Respiratory system > R05 - Cough and cold preparations > R05D - Cough suppressants, excl. combinations with expectorants C78273 - Agent Affecting Respiratory System > C66917 - Antitussive Agent D019141 - Respiratory System Agents > D000996 - Antitussive Agents D002491 - Central Nervous System Agents Levodropropizine (DF-526) is an orally active histamine receptor inhibitor, Levodropropizine is an effective and very well tolerated peripheral antitussive agent[1].
(r)-[1-(4-amino-phenyl)-ethyl]-carbamic acid tert-butyl ester
C13H20N2O2 (236.15247000000002)
TERT-BUTYL 3-AMINOPHENETHYLCARBAMATE
C13H20N2O2 (236.15247000000002)
5-Methyl-7-phenyl-6,7-dihydro-1H-1,4-diazepine-2,3-dicarbonitrile
2-(3-fluoro-4-methylphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
Tetrahydrozoline hydrochloride
D018373 - Peripheral Nervous System Agents > D001337 - Autonomic Agents > D013566 - Sympathomimetics C78272 - Agent Affecting Nervous System > C29747 - Adrenergic Agent > C87053 - Adrenergic Agonist D019999 - Pharmaceutical Solutions > D009883 - Ophthalmic Solutions D019141 - Respiratory System Agents > D014663 - Nasal Decongestants D002317 - Cardiovascular Agents > D014662 - Vasoconstrictor Agents Tetrahydrozoline hydrochloride (Tetryzoline hydrochloride), a derivative of imidazoline, is an α-adrenergic agonist that causes vasoconstriction. Tetrahydrozoline hydrochloride is widely used for the research of nasal congestion and conjunctival congestion[1][2].
tert-butyl 2-methylpiperazine-1-carboxylate,hydrochloride
N-(1-hydroxy-2-methylpropan-2-yl)piperidine-4-carboxamide
1-[3-(2-METHOXY-ETHOXY)-PHENYL]-PIPERAZINE
C13H20N2O2 (236.15247000000002)
4-(2,2-DIMETHYL-PROPIONYLAMINO)-NICOTINIC ACID METHYL ESTER
1(2H)-Naphthalenone, 3,4-dihydro-7-(phenylmethyl)-
tert-Butyl 2-amino-5H-pyrrolo[3,4-d]pyrimidine-6(7H)-carboxylate
tert-Butyl [3-(aminomethyl)benzyl]carbamate
C13H20N2O2 (236.15247000000002)
4-(Piperidin-4-ylmethyl)benzonitrile hydrochloride
N,N-Diisopropyl-4-methoxypicolinamide
C13H20N2O2 (236.15247000000002)
N-(3-(3-Hydroxypropyl)pyridin-2-yl)pivalamide
C13H20N2O2 (236.15247000000002)
TERT-BUTYL 3-(AMINOMETHYL)PYRROLIDINE-1-CARBOXYLATE HYDROCHLORIDE
N-butyl-N-ethyl-3-methyl-4-nitroaniline
C13H20N2O2 (236.15247000000002)
3-methyl-4-nitro-N,N-dipropylaniline
C13H20N2O2 (236.15247000000002)
2-METHOXY-4-((1-METHYLPIPERIDIN-4-YL)OXY)ANILINE
C13H20N2O2 (236.15247000000002)
(11R,12R)-9,10-DIHYDRO-9,10-ETHANOANTHRACENE-11,12-DIAMINE
2-methyl-2-(5-methyl-2-propan-2-ylphenoxy)propanoic acid
tert-butyl N-[(E)-(3-hydroxyphenyl)methylideneamino]carbamate
5,6,7,8-TETRAHYDRO-3H-SPIRO[CYCLOHEXANE-1,4-QUINAZOLINE]-2-THIOL
tert-Butyl 4-amino-3,3-difluoropiperidine-1-carboxylate
3-N-CBZ-3-Methylbutane-1,3-diamine
C13H20N2O2 (236.15247000000002)
tert-Butyl [4-(aminomethyl)benzyl]carbamate
C13H20N2O2 (236.15247000000002)
tert-butyl 6,6-difluoro-1,4-diazepane-1-carboxylate
{4-[(Tetrahydro-2H-pyran-2-yloxy)methyl]phenyl}boronic acid
C12H17BO4 (236.12198320000002)
tert-butyl (2-amino-1-phenylethyl)carbamate
C13H20N2O2 (236.15247000000002)
2-Butoxy-3-formyl-5-methylphenylboronic acid
C12H17BO4 (236.12198320000002)
1-[2-(4-Methoxy-phenoxy)-ethyl]-piperazine
C13H20N2O2 (236.15247000000002)
2-(3,4,5-trimethoxyphenyl)-4,5-dihydro-1H-imidazole
3-[1-(Dimethylamino)ethyl]phenol dimethylcarbamate (ester)
C13H20N2O2 (236.15247000000002)
(S)-TERT-BUTYL 3-(METHYLAMINO)PYRROLIDINE-1-CARBOXYLATE HYDROCHLORIDE
4-(3-morpholin-4-ylpropoxy)aniline
C13H20N2O2 (236.15247000000002)
Butethamine
C13H20N2O2 (236.15247000000002)
C78272 - Agent Affecting Nervous System > C245 - Anesthetic Agent
2-MethoxypyriMidine-5-boronic acid pinacol ester
C11H17BN2O3 (236.13321620000002)
1-Isopropyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole
C12H21BN2O2 (236.16959960000003)
(2R,3R,5S,6S)-5,6-Bis(hydroxyMethyl)-2,3-diMethoxy-2,3-diMethyl-1,4-dioxane
tert-Butyl (2-amino-2-phenylethyl)carbamate
C13H20N2O2 (236.15247000000002)
1-METHYL-4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-1H-PYRAZOLE-3-CARBOXALDEHYDE
C11H17BN2O3 (236.13321620000002)
tert-butyl N-[2-(azetidin-3-yl)ethyl]carbamate hydrochloride
tert-Butyl (3-aminocyclopentyl)carbamate hydrochloride
1-Pyrrolidinecarboxylic acid, 4-amino-2-(difluoromethyl)-, 1,1-d
7-[(4-fluorophenyl)methyl]-3-oxa-7,9-diazabicyclo[3.3.1]nonane
Kondensationsprodukte von Dicarbonsuren mit mehrwertigen aliphatischen Alkoholen verestert
TERT-BUTYL (1-(2-AMINOPHENYL)ETHYL)CARBAMATE
C13H20N2O2 (236.15247000000002)
[1-(3-AMINO-PHENYL)-ETHYL]-CARBAMIC ACID TERT-BUTYL ESTER
C13H20N2O2 (236.15247000000002)
5-amino-2-morpholin-4-yl-benzoic acid methyl ester
1,3,5-TRIMETHYL-4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-1H-PYRAZOLE
C12H21BN2O2 (236.16959960000003)
4-((tert-butyldimethylsilyl)oxy)benzald
C13H20O2Si (236.12325000000004)
(2S,3S,5R,6R)-5,6-Bis(hydroxyMethyl)-2,3-dimethoxy-2,3-dimethyl-1,4-dioxane
N-[2-(diethylamino)ethyl]-2-hydroxybenzamide
C13H20N2O2 (236.15247000000002)
3-methyl-2-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-3,4-dihydropyrazol-5-amine
C11H16N4S (236.10956159999998)
[2-(1-amino-ethyl)-phenyl]-carbamic acid tert-butyl ester
C13H20N2O2 (236.15247000000002)
2-)4-METHOXYPHENYL)-2-MORPHOLIN-4-YETHYLAMINE DIHYDROCHLORIDE
C13H20N2O2 (236.15247000000002)
2,3,5,6-tetradeuterio-4-[2-(2,3,5,6-tetradeuterio-4-hydroxyphenyl)propan-2-yl]phenol
6-[(2-amino-2-methyl-propyl)amino]-N,N-dimethyl-pyridine-3-carbox amide
N-(oxolan-2-ylmethyl)-2-(propan-2-ylamino)acetamide,hydrochloride
(9R,10R,11S,12S)-9,10-dihydro-9,10-ethanoanthracene-11,12-diamine
1-METHYL-4-PHENYLPIPERIDINE-4-CARBONITRILE HYDROCHLORIDE
[3-[1-(methylamino)ethyl]phenyl] N-ethyl-N-methylcarbamate
C13H20N2O2 (236.15247000000002)
3-[tert-butyl(dimethyl)silyl]oxybenzaldehyde
C13H20O2Si (236.12325000000004)
2-(4-TERT-BUTYLPHENOXY)PROPANOHYDRAZIDE
C13H20N2O2 (236.15247000000002)
2-hydroxy-3,5-di(propan-2-yl)benzohydrazide
C13H20N2O2 (236.15247000000002)
6-(CHLOROMETHYL)-1,1,4,4-TETRAMETHYL-1,2,3,4-TETRAHYDRONAPHTHALENE
2-[(1S,2S)-1-Ethyl-2-(phenylmethoxy)propyl]hydrazinecarboxaldehyde
C13H20N2O2 (236.15247000000002)
1-[4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazol-1-yl]-ethanone
C11H17BN2O3 (236.13321620000002)
(R)-tert-Butyl (pyrrolidin-3-ylmethyl)carbamate hydrochloride
(S)-tert-Butyl 2-(aminomethyl)pyrrolidine-1-carboxylate hydrochloride
(S)-tert-Butyl (pyrrolidin-2-ylmethyl)carbamate hydrochloride
(S)-tert-Butyl (pyrrolidin-3-ylmethyl)carbamate hydrochloride
3-METHOXY-4-(2-PYRROLIDIN-1-YL-ETHOXY)-PHENYLAMINE
C13H20N2O2 (236.15247000000002)
THEED (N,N,N,N-Tetrakis(2-hydroxyethyl)ethylenediamine
C10H24N2O4 (236.17359839999997)
[2-(2-MORPHOLINOETHOXY)PHENYL]METHYLAMINE
C13H20N2O2 (236.15247000000002)
tert-butyl N-[[2-(aminomethyl)phenyl]methyl]carbamate
C13H20N2O2 (236.15247000000002)
3-(2-MORPHOLINOETHOXY)PHENYL]METHYLAMINE
C13H20N2O2 (236.15247000000002)
1-(1-METHYLETHYL)-3-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-1H-PYRAZOLE
C12H21BN2O2 (236.16959960000003)
2-(2,2-Dimethyl-propionylamino)-isonicotinic acid methyl ester
N-[4-(hydrazinecarbonyl)pyridin-2-yl]-2,2-dimethylpropanamide
6-Methoxypyrazine-2-boronic acid pinacol ester
C11H17BN2O3 (236.13321620000002)
2-(4,4-Difluoropiperidin-1-yl)-2-phenylacetonitrile
2-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)ethanamine
C13H20N2O2 (236.15247000000002)
3-boc-8-cyano-3-azabicyclo[3.2.1]octane
C13H20N2O2 (236.15247000000002)
(3-(CYCLOPENTYLOXY)-4-METHOXYPHENYL)BORONIC ACID
C12H17BO4 (236.12198320000002)
(3-((2-(DIMETHYLAMINO)ETHYL)CARBAMOYL)PHENYL)BORONIC ACID
C11H17BN2O3 (236.13321620000002)
5-Methyl-2-cyclohexene-1-one-3-boronic acid pinacol ester
C13H21BO3 (236.15836660000002)
1-((2-(2-methoxyethoxy)ethoxy)methyl)-4-vinylbenzene
8-(2-Acetyloxiran-2-yl)-6,6-dimethylocta-3,4-dien-2-one
(S)-3-[1-(methylamino)ethyl]-phenyl N-ethyl-N-methyl-carbamate
C13H20N2O2 (236.15247000000002)
tert-Butyl ((3-methylazetidin-3-yl)methyl)carbamate hydrochloride
alpha-Oxotricyclo[3.3.1.1(3,7)]decane-1-acetic acid ethyl ester
tert-butyl N-[2-(2-aminophenyl)ethyl]carbamate
C13H20N2O2 (236.15247000000002)
methyl 4-({[2-(dimethylamino)ethyl]amino}methyl)benzoate
C13H20N2O2 (236.15247000000002)
4-Amino-1-piperidinecarboxylic acid tert-butyl ester hydrochloride
Acetamide,N-[3-[(diethylamino)methyl]-4-hydroxyphenyl]-
C13H20N2O2 (236.15247000000002)
TERT-BUTYL 4-(1-AMINOETHYL)PHENYLCARBAMATE
C13H20N2O2 (236.15247000000002)
1-(2,5-DIMETHOXY-BENZYL)-PIPERAZINE
C13H20N2O2 (236.15247000000002)
4-(2-MORPHOLINOETHOXY)PHENYL]METHYLAMINE
C13H20N2O2 (236.15247000000002)
N-((6-CHLORO-1H-INDOL-3-YL)METHYL)-N-ETHYLETHANAMINE
1-Isopropyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole
C12H21BN2O2 (236.16959960000003)
5,6,7,8-TETRAHYDROSPIRO[3,1-BENZOTHIAZINE-4,1-CYCLOHEXAN]-2-AMINE
1,4]DIAZEPANE-1-CARBOXYLIC ACIDTERT-BUTYL ESTERHYDROCHLORIDE
1-Propyl-1H-pyrazole-4-boronic acid pinacol ester
C12H21BN2O2 (236.16959960000003)
4-Acetylamino-2-(diethylamino)anisole
C13H20N2O2 (236.15247000000002)
Ethanone, 1-phenyl-,2-(1-phenylethylidene)hydrazone
3-Ethyl-1,1,1,5,5,5-hexamethyltrisiloxane
C8H24O2Si3 (236.10840439999998)
1-[2-(2-METHOXY-ETHOXY)-PHENYL]-PIPERAZINE
C13H20N2O2 (236.15247000000002)
Acetamide,N-[4-(1,1-dimethylethyl)-2-nitrophenyl]-
3-AMINO-3-(4-DIETHYLAMINO-PHENYL)-PROPIONIC ACID
C13H20N2O2 (236.15247000000002)
Silane, (2-methoxy-4-propenylphenoxy)trimethyl-
C13H20O2Si (236.12325000000004)
6-Trimethylsilylmethyl-3,4,4a,5,8,8a-hexahydro-1(2H)-naphthalenone
C14H24OSi (236.15963339999996)
alpha-D-Glucopyranoside, methyl 2,3,6-tri-O-methyl-
4H-Pyrido[1,2-a]pyrimidine-3-acetic acid, 6,7,8,9-tetrahydro-4-oxo-, ethyl ester
Ethyl 1-methyl-4-oxo-1,6,7,8-tetrahydro-4H-pyrido[1,2-a]pyrimidine-3-carboxylate
Butyrophenone, 2-(trimethylsiloxy)-
C13H20O2Si (236.12325000000004)
4-[(Isopropylamino)Methyl]Phenylalanine
C13H20N2O2 (236.15247000000002)
Hexobarbital
D002491 - Central Nervous System Agents > D002492 - Central Nervous System Depressants > D006993 - Hypnotics and Sedatives N - Nervous system > N05 - Psycholeptics > N05C - Hypnotics and sedatives > N05CA - Barbiturates, plain N - Nervous system > N01 - Anesthetics > N01A - Anesthetics, general > N01AF - Barbiturates, plain C78272 - Agent Affecting Nervous System > C29756 - Sedative and Hypnotic > C67084 - Barbiturate D018377 - Neurotransmitter Agents > D018682 - GABA Agents > D018757 - GABA Modulators
cyclobarbital
N - Nervous system > N05 - Psycholeptics > N05C - Hypnotics and sedatives > N05CA - Barbiturates, plain C78272 - Agent Affecting Nervous System > C29756 - Sedative and Hypnotic
1,5,5,8-Tetramethyl-12-thiabicyclo[9.1.0]dodeca-3,7-diene
1,5,5,8-Tetramethyl-12-thiabicyclo[9.1.0]dodeca-3,7-diene is a constituent of hops. Constituent of hops
1-(4-methoxyphenyl)-N-methyl-N-[(3-methyloxetan-3-yl)methyl]methanamine
(13aS)-5,6,7,8,13,13a-hexahydroisoquinolino[2,1-b]isoquinolin-7-ium
3,4a-Dihydroxy-4-methyl-6-prop-1-en-2-yl-3,4,5,6,7,8-hexahydronaphthalen-2-one
(2S)-2-{[(2S)-2-azaniumyl-3-phenylpropanoyl]amino}propanoate
N-cyclohexyl-5-propyl-1,2-oxazole-3-carboxamide
C13H20N2O2 (236.15247000000002)
N-(3,3,5-trimethylcyclohexyl)-1H-1,2,4-triazole-5-carboxamide
Decylsulfamate
An organic sulfamate oxoanion that is the conjugate base of decylsulfamic acid. It has been isolated from Daphnia pulex and has been shown to cause morphological changes in the green alga Scenedesmus gutwinskii.
1-Butan-2-yl-3-(4-ethoxyphenyl)urea
C13H20N2O2 (236.15247000000002)
(8-Methylnonyl)sulfamate
An organic sulfamate oxoanion that is the conjugate base of (8-methylnonyl)sulfamic acid. It has been isolated from Daphnia pulex and has been shown to cause morphological changes in the green alga Scenedesmus gutwinskii.
(3E)-dec-3-en-1-yl hydrogen sulfate
A sulfuric ester obtained by the formal condensation of (3E)-dec-3-en-1-ol with sulfuric acid.
(3Z)-dec-3-en-1-yl hydrogen sulfate
A sulfuric ester of (3Z)-dec-3-en-1-ol.
N-(4-aminobutyl)-3-(4-hydroxyphenyl)propanamide
C13H20N2O2 (236.15247000000002)
4-Methyl-1-oxido-6-(2,4,4-trimethylpentyl)pyridin-2-one
(4-Allyl-2-methoxyphenoxy)trimethylsilane
C13H20O2Si (236.12325000000004)
(2R/S)-2-[4-(2-Hydroxy-2-methylpropyl)-phenyl]-propionic acid methyl ester
Para-(tert-butoxydimethylsilyl)benzaldehyde
C13H20O2Si (236.12325000000004)
1-Trimethylsilyloxy-4-(1,1-dimethylpropyl)benzene
C14H24OSi (236.15963339999996)
2-Phenylbutyric acid, TMS derivative
C13H20O2Si (236.12325000000004)
2-Methyl-6-tert-butylphenol, TMS derivative
C14H24OSi (236.15963339999996)
2-Methyl-4-phenyl-2-trimethylsilyloxybutane
C14H24OSi (236.15963339999996)
2-Methyl-1-phenyl-2-(trimethylsilyloxy)propan-1-one
C13H20O2Si (236.12325000000004)
Benzoic acid, 2,4,6-trimethyl-, trimethylsilyl ester
C13H20O2Si (236.12325000000004)
3-Phenyl-3-(trimethylsilyloxy)butan-2-one
C13H20O2Si (236.12325000000004)
3-(Para-methoxyphenyl)-2-trimethylsiloxypropene
C13H20O2Si (236.12325000000004)
3,4,4a,5,8,8a-Hexahydro-7-trimethylsilylmethyl-1(2H)-naphthalenone
C14H24OSi (236.15963339999996)
1,3-Dihydro-3,3-dimethyl-1-trimethylsilyl-3-silaisobenzofuran
Acetamide, N-(3-(2-amino-5-methoxyphenyl)-3-oxopropyl)-
Heptylparaben
D010592 - Pharmaceutic Aids > D011310 - Preservatives, Pharmaceutical > D010226 - Parabens
Phe-Ala zwitterion
A peptide zwitterion obtained by transfer of a proton from the carboxy to the amino terminus of Phe-Ala; major species at pH 7.3.
ST1936
ST1936 is a selective, nanomolar affinity 5-HT6 receptor agonist with Ki values of 13 nM, 168 nM and 245 nM for human 5-HT6, 5-HT7 and 5-HT2B receptors, respectively. ST1936 also shows moderate affinity (Ki of 300 nM) for human and rat α2 adrenergic receptor[1].