Exact Mass: 236.1439
Exact Mass Matches: 236.1439
Found 500 metabolites which its exact mass value is equals to given mass value 236.1439,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Procaine
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
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
N - Nervous system > N01 - Anesthetics > N01B - Anesthetics, local > N01BA - Esters of aminobenzoic acid C78272 - Agent Affecting Nervous System > C245 - Anesthetic Agent
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.
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
Dropropizine
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
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
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-
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
(E)-form-12-Tetradecene-8,10-diyne-1,3,14-triol,|Tetradeca-2t-en-4,6-diin-1,12,14-triol
12-Tetradecene-8,10-diyne-1,4,5-triol|tetradeca-12t-ene-8,10-diyne-1,4,5-triol
(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
1-n-butyl-1beta-D-fructopyranoside|1-O-butyl-beta-D-fructopyranoside
(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
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.
procaine
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
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
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
2-(3-fluoro-4-methylphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
tert-butyl 2-methylpiperazine-1-carboxylate,hydrochloride
N-(1-hydroxy-2-methylpropan-2-yl)piperidine-4-carboxamide
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)PYRROLIDINE-1-CARBOXYLATE HYDROCHLORIDE
(11R,12R)-9,10-DIHYDRO-9,10-ETHANOANTHRACENE-11,12-DIAMINE
2-methyl-2-(5-methyl-2-propan-2-ylphenoxy)propanoic acid
5,6,7,8-TETRAHYDRO-3H-SPIRO[CYCLOHEXANE-1,4-QUINAZOLINE]-2-THIOL
tert-Butyl 4-amino-3,3-difluoropiperidine-1-carboxylate
tert-butyl 6,6-difluoro-1,4-diazepane-1-carboxylate
{4-[(Tetrahydro-2H-pyran-2-yloxy)methyl]phenyl}boronic acid
3-[1-(Dimethylamino)ethyl]phenol dimethylcarbamate (ester)
(S)-TERT-BUTYL 3-(METHYLAMINO)PYRROLIDINE-1-CARBOXYLATE HYDROCHLORIDE
1-Isopropyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole
(2R,3R,5S,6S)-5,6-Bis(hydroxyMethyl)-2,3-diMethoxy-2,3-diMethyl-1,4-dioxane
1-METHYL-4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-1H-PYRAZOLE-3-CARBOXALDEHYDE
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
[1-(3-AMINO-PHENYL)-ETHYL]-CARBAMIC ACID TERT-BUTYL ESTER
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
(2S,3S,5R,6R)-5,6-Bis(hydroxyMethyl)-2,3-dimethoxy-2,3-dimethyl-1,4-dioxane
[2-(1-amino-ethyl)-phenyl]-carbamic acid tert-butyl ester
2-)4-METHOXYPHENYL)-2-MORPHOLIN-4-YETHYLAMINE DIHYDROCHLORIDE
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
[3-[1-(methylamino)ethyl]phenyl] N-ethyl-N-methylcarbamate
6-(CHLOROMETHYL)-1,1,4,4-TETRAMETHYL-1,2,3,4-TETRAHYDRONAPHTHALENE
2-[(1S,2S)-1-Ethyl-2-(phenylmethoxy)propyl]hydrazinecarboxaldehyde
1-[4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazol-1-yl]-ethanone
(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
tert-butyl N-[[2-(aminomethyl)phenyl]methyl]carbamate
1-(1-METHYLETHYL)-3-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-1H-PYRAZOLE
2-(2,2-Dimethyl-propionylamino)-isonicotinic acid methyl ester
N-[4-(hydrazinecarbonyl)pyridin-2-yl]-2,2-dimethylpropanamide
2-(6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)ethanamine
(3-((2-(DIMETHYLAMINO)ETHYL)CARBAMOYL)PHENYL)BORONIC ACID
5-Methyl-2-cyclohexene-1-one-3-boronic acid pinacol ester
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
tert-Butyl ((3-methylazetidin-3-yl)methyl)carbamate hydrochloride
alpha-Oxotricyclo[3.3.1.1(3,7)]decane-1-acetic acid ethyl ester
methyl 4-({[2-(dimethylamino)ethyl]amino}methyl)benzoate
4-Amino-1-piperidinecarboxylic acid tert-butyl ester hydrochloride
Acetamide,N-[3-[(diethylamino)methyl]-4-hydroxyphenyl]-
1-Isopropyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole
5,6,7,8-TETRAHYDROSPIRO[3,1-BENZOTHIAZINE-4,1-CYCLOHEXAN]-2-AMINE
1,4]DIAZEPANE-1-CARBOXYLIC ACIDTERT-BUTYL ESTERHYDROCHLORIDE
Ethanone, 1-phenyl-,2-(1-phenylethylidene)hydrazone
Acetamide,N-[4-(1,1-dimethylethyl)-2-nitrophenyl]-
6-Trimethylsilylmethyl-3,4,4a,5,8,8a-hexahydro-1(2H)-naphthalenone
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
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-(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.
(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.
4-Methyl-1-oxido-6-(2,4,4-trimethylpentyl)pyridin-2-one
(2R/S)-2-[4-(2-Hydroxy-2-methylpropyl)-phenyl]-propionic acid methyl ester
2-Methyl-1-phenyl-2-(trimethylsilyloxy)propan-1-one
Benzoic acid, 2,4,6-trimethyl-, trimethylsilyl ester
3,4,4a,5,8,8a-Hexahydro-7-trimethylsilylmethyl-1(2H)-naphthalenone
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.
(2s)-2-amino-5-{[hydroxy(phenyl)methylidene]amino}pentanoic acid
[(2s)-2-[4-methyl-2-(2-methylpropoxy)phenyl]oxiran-2-yl]methanol
(4r,5ar,8r,8as)-8-hydroxy-4,7,7-trimethyl-3h,4h,5h,5ah,6h,8h,8ah-indeno[4,5-c]furan-1-one
(4s,5s)-4-hydroxy-2-methyl-5-(5-methylhex-4-enoyl)cyclohex-2-en-1-one
8-hydroxy-7,9b-dimethyl-3h,3ah,5ah,6h,7h,8h,9h,9ah-naphtho[1,2-c]furan-1-one
(3as,5ar,7r,8r,9as,9br)-8-hydroxy-7,9b-dimethyl-3h,3ah,5ah,6h,7h,8h,9h,9ah-naphtho[1,2-c]furan-1-one
2a,4-dihydroxy-3,6,7b-trimethyl-1h,2h,3h,4h,5h,6h-cyclobuta[e]inden-7-one
(5r,5as,7s,9as,9br)-5-hydroxy-7,9b-dimethyl-3h,5h,5ah,6h,7h,8h,9h,9ah-naphtho[1,2-c]furan-1-one
7-hydroxy-7,9b-dimethyl-3h,3ah,5ah,6h,8h,9h,9ah-naphtho[1,2-c]furan-1-one
7-(hydroxymethyl)-9b-methyl-3h,3ah,5ah,6h,7h,8h,9h,9ah-naphtho[1,2-c]furan-1-one
(5r,6r)-6-butyl-8,9-dimethyl-1-oxaspiro[4.4]non-8-ene-2,7-dione
4-[4-(3-hydroxypropyl)phenoxy]-2-methylbut-2-en-1-ol
(4as)-7-[(2s)-1,2-dihydroxypropan-2-yl]-4a-methyl-3,4,5,6-tetrahydronaphthalen-2-one
5-acetyl-4,4a-dimethyl-hexahydro-1ah-naphtho[4,4a-b]oxiren-6-one
(3ar,5ar,7s,9as,9br)-3a-hydroxy-7,9b-dimethyl-3h,5ah,6h,7h,8h,9h,9ah-naphtho[1,2-c]furan-1-one
(3as,5ar,7r,8s,9as,9br)-8-hydroxy-7,9b-dimethyl-3h,3ah,5ah,6h,7h,8h,9h,9ah-naphtho[1,2-c]furan-1-one
(2r)-2-[(1e,5r)-5-hydroxyhex-1-en-1-yl]-2-methyl-5-[(1e)-prop-1-en-1-yl]furan-3-one
[5-(6-methoxypyridin-2-yl)-1-methylpiperidin-3-yl]methanol
1-acetyl-6-hydroxy-8,8a-dimethyl-1,3,4,6,7,8-hexahydronaphthalen-2-one
1,1,3-Trimethyl-3-phenylindane
{"Ingredient_id": "HBIN000310","Ingredient_name": "1,1,3-Trimethyl-3-phenylindane","Alias": "NA","Ingredient_formula": "C18H20","Ingredient_Smile": "CC1(CC(C2=CC=CC=C21)(C)C3=CC=CC=C3)C","Ingredient_weight": "236.4 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "40552","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "19793","DrugBank_id": "NA"}
2,4-Diphenyl-4-methyl-2-pentene
{"Ingredient_id": "HBIN004369","Ingredient_name": "2,4-Diphenyl-4-methyl-2-pentene","Alias": "NA","Ingredient_formula": "C18H20","Ingredient_Smile": "CC(=CC(C)(C)C1=CC=CC=C1)C2=CC=CC=C2","Ingredient_weight": "236.4 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "41030","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "5376315","DrugBank_id": "NA"}
3(10)-Caren-4-ol, acetoacetic acid ester
{"Ingredient_id": "HBIN006892","Ingredient_name": "3(10)-Caren-4-ol, acetoacetic acid ester","Alias": "NA","Ingredient_formula": "C14H20O3","Ingredient_Smile": "CC(=O)CC(=O)OC1CC2C(C2(C)C)CC1=C","Ingredient_weight": "236.31 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "40809","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "538448","DrugBank_id": "NA"}
ailanthoidiol
{"Ingredient_id": "HBIN014940","Ingredient_name": "ailanthoidiol","Alias": "NA","Ingredient_formula": "C14H20O3","Ingredient_Smile": "CC(CCOC1=CC=C(C=C1)C=CCO)CO","Ingredient_weight": "236.31 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "775","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "5316925","DrugBank_id": "NA"}
β-n-butyl-d-tagatopyranoside
{"Ingredient_id": "HBIN018203","Ingredient_name": "\u03b2-n-butyl-d-tagatopyranoside","Alias": "NA","Ingredient_formula": "C10H20O6","Ingredient_Smile": "CCCCOC1(C(C(C(CO1)O)O)O)CO","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "SMIT14540","TCMID_id": "2806","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
