Exact Mass: 222.12314279999998
Exact Mass Matches: 222.12314279999998
Found 500 metabolites which its exact mass value is equals to given mass value 222.12314279999998,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
(+)-Dehydrovomifoliol
(+)-dehydrovomifoliol, also known as (6s)-6-hydroxy-3-oxo-alpha-ionone, is a member of the class of compounds known as sesquiterpenoids. Sesquiterpenoids are terpenes with three consecutive isoprene units. Thus, (+)-dehydrovomifoliol is considered to be an isoprenoid lipid molecule (+)-dehydrovomifoliol is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). (+)-dehydrovomifoliol can be found in rice, which makes (+)-dehydrovomifoliol a potential biomarker for the consumption of this food product. (6S)-dehydrovomifoliol is a dehydrovomifoliol that has S-configuration at the chiral centre. It has a role as a plant metabolite. It is an enantiomer of a (6R)-dehydrovomifoliol. Dehydrovomifoliol is a natural product found in Psychotria correae, Dendrobium loddigesii, and other organisms with data available.
3-Isobutyl-1-methylxanthine
D004791 - Enzyme Inhibitors > D010726 - Phosphodiesterase Inhibitors
zectran
C471 - Enzyme Inhibitor > C47792 - Acetylcholinesterase Inhibitor
Buthionine sulfoximine
Buthionine Sulfoximine is a synthetic amino acid. Buthionine sulfoximine irreversibly inhibits gamma-glutamylcysteine synthase, thereby depleting cells of glutathione, a metabolite that plays a critical role in protecting cells against oxidative stress, and resulting in free radical-induced apoptosis. Elevated glutathione levels are associated with tumor cell resistance to alkylating agents and platinum compounds. By depleting cells of glutathione, this agent may enhance the in vitro and in vivo cytotoxicities of various chemotherapeutic agents in drug-resistant tumors. Buthionine sulfoximine may also exhibit antiangiogenesis activity. (NCI04) D020011 - Protective Agents > D011837 - Radiation-Protective Agents D009676 - Noxae > D000963 - Antimetabolites D011838 - Radiation-Sensitizing Agents D000970 - Antineoplastic Agents D004791 - Enzyme Inhibitors Buthionine sulfoximine. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. https://commonchemistry.cas.org/detail?cas_rn=5072-26-4 (retrieved 2024-09-04) (CAS RN: 5072-26-4). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).
3-Hydroxymonoethylglycinexylidide
3-Hydroxymonoethylglycinexylidide is a metabolite of lidocaine. Lidocaine, Xylocaine, or lignocaine is a common local anesthetic and antiarrhythmic drug. Lidocaine is used topically to relieve itching, burning and pain from skin inflammations, injected as a dental anesthetic or as a local anesthetic for minor surgery. (Wikipedia)
Dehydrovomifoliol
Isolated from rice husks (Oryza sativa L. cv Koshihikari). Dehydrovomifoliol is found in tea, cereals and cereal products, and common grape. Dehydrovomifoliol is found in cereals and cereal products. Dehydrovomifoliol is isolated from rice husks (Oryza sativa L. cv Koshihikari).
1-Hydroxyibuprofen
1-Hydroxyibuprofen is a metabolite of ibuprofen. Ibuprofen is a nonsteroidal anti-inflammatory drug (NSAID) used for relief of symptoms of arthritis, fever, as an analgesic (pain reliever), especially where there is an inflammatory component, and dysmenorrhea. Ibuprofen is known to have an antiplatelet effect, though it is relatively mild and somewhat short-lived when compared with aspirin or other better-known antiplatelet drugs. (Wikipedia)
Glycylphenylalanine
Glycyl-Phenylalanine is a dipeptide composed of glycine 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. This dipeptide has not yet been identified in human tissues or biofluids and so it is classified as an Expected metabolite.
Isopropyl beta-D-glucoside
Isopropyl beta-D-glucoside is found in herbs and spices. Isopropyl beta-D-glucoside is present in fenne Present in fennel. Isopropyl beta-D-glucoside is found in herbs and spices.
(all-E)-1,7,9-Heptadecatriene-11,13,15-triyne
(all-E)-1,7,9-Heptadecatriene-11,13,15-triyne is a constituent of Artemisia vulgaris (mugwort)
Phenylalanylglycine
Phenylalanylglycine is a dipeptide composed of phenylalanine and glycine. 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.
Annuionone B
Annuionone B is found in fats and oils. Annuionone B is a constituent of Helianthus annuus (sunflower) Constituent of Helianthus annuus (sunflower). Annuionone B is found in sunflower and fats and oils.
Isoamyl p-anisate
Isoamyl p-anisate is a food flavouring agent. Food flavouring agent
2-Hydroxyibuprofen
2-Hydroxyibuprofen is a metabolite of ibuprofen. Ibuprofen is a nonsteroidal anti-inflammatory drug (NSAID) used for relief of symptoms of arthritis, fever, as an analgesic (pain reliever), especially where there is an inflammatory component, and dysmenorrhea. Ibuprofen is known to have an antiplatelet effect, though it is relatively mild and somewhat short-lived when compared with aspirin or other better-known antiplatelet drugs. (Wikipedia)
3-Hydroxyibuprofen
3-Hydroxyibuprofen is a metabolite of ibuprofen. Ibuprofen is a nonsteroidal anti-inflammatory drug (NSAID) used for relief of symptoms of arthritis, fever, as an analgesic (pain reliever), especially where there is an inflammatory component, and dysmenorrhea. Ibuprofen is known to have an antiplatelet effect, though it is relatively mild and somewhat short-lived when compared with aspirin or other better-known antiplatelet drugs. (Wikipedia)
Hexyl salicylic acid
Hexyl salicylic acid belongs to the class of organic compounds known as benzoic acid esters. These are ester derivatives of benzoic acid. D000893 - Anti-Inflammatory Agents > D000894 - Anti-Inflammatory Agents, Non-Steroidal > D012459 - Salicylates
(2R)-2-Amino-4-(amino-butyl-oxo-lambda6-sulfanylidene)butanoic acid
3-Methyl-1-(2-methylpropyl)-7H-purine-2,6-dione
3-Hexylsalicylic acid
D000893 - Anti-Inflammatory Agents > D000894 - Anti-Inflammatory Agents, Non-Steroidal > D012459 - Salicylates
3,5-Diisopropylsalicylic acid
D000893 - Anti-Inflammatory Agents > D000894 - Anti-Inflammatory Agents, Non-Steroidal > D012459 - Salicylates
3,7-Dihydro-8-methyl-3-(2-methylpropyl)-1H-purine-2,6-dione
Morinamide
J - Antiinfectives for systemic use > J04 - Antimycobacterials > J04A - Drugs for treatment of tuberculosis C254 - Anti-Infective Agent > C52588 - Antibacterial Agent > C280 - Antitubercular Agent
Nicametate
C78274 - Agent Affecting Cardiovascular System > C29707 - Vasodilating Agent D002317 - Cardiovascular Agents > D014665 - Vasodilator Agents
3-Methyl-8-(2-methylpropyl)-7H-purine-2,6-dione
9-Methyl-3-(2-methylpropyl)purine-2,6-dione
3-Methyl-9-(2-methylpropyl)purine-2,6-dione
Methyl 3-epi-4,5-didehydrojasmonate
Constituent of Jasminum species Methyl 3-epi-4,5-didehydrojasmonate is found in tea and herbs and spices.
2,4,6-Tri-O-methyl-D-glucopyranose|2,4,6-tri-O-methyl-D-glucose|2,4,6-tri-O-methylglucopyranose|2,4,6-tri-O-methylglucose|2,4,6-trimethyl-D-glucose|O2,O4,O6-trimethyl-D-glucose
3,4-dimethoxy-6-(methoxymethyl)-tetrahydro-2h-pyran-2,5-diol
5-methyl-2-(2,2,4-trimethyl-1,3-dioxolan-4-yl)phenol|acetone thymol 8,9-diyl ketal
4-Isopropyl-3-methoxybenzylacetat|7-acetoxythymol methyl ether
(E,4R)-4-hydroxy-4,5,5-trimethyl-3-(3-oxobut-1-enyl)cyclohex-2-enone
aconicaramide|N-(L-prolyl)-5-hydroxymethyl-1H-pyrrole-2-carbaldehyde
(3R,4S)-6,8-dihydroxy-3,4,5,7-tetramethylisochroman
3,4,6-Tri-Me-Glc|3,4,6-tri-O-methyl-D-glucose|3,4,6-tri-O-methylglucose|D-gluco-2,5-Dihydroxy-3,4,6-trimethoxy-hexanal|O3,O4,O6-trimethyl-D-glucose
alpha-Methyl-7-(2-hydroxyethyl)-3,4-dihydro-2H-1-benzopyran-2-methanol
2,4,6-Tri-O-methyl-mannose|2.4.6-Tri-O-methyl-D-mannose|D-manno-3,5-Dihydroxy-2,4,6-trimethoxy-hexanal|O2,O4,O6-trimethyl-D-mannose
2,3,4,-Tri-O-methyl-D-galactose|2,3,4-Tri-O-methyl-D-galactopyranose|2,3,4-tri-O-methyl-D-galactose|2,3,4-Tri-O-methyl-D-galaktose|2,3,4-Tri-O-methylgalactose|O2,O3,O4-trimethyl-D-galactose
2-Hydroxy-5-(1-hydroxyethyl)-beta-methylbutyrophenone
Benzeneacetaldehyde, .alpha.-(2-phenylethylidene)-
(E)-6-(hex-2-en-2-yl)-4-methoxy-3-methyl-2H-pyran-2-one|aplysiopsene C
(E)-4-methoxy-3-methyl-6-(4-methylpent-2-en-2-yl)-2H-pyran-2-one|aplysiopsene B
(2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-propan-2-yloxyoxane-3,4,5-triol
Hexylparaben
CONFIDENCE standard compound; INTERNAL_ID 1384; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5332; ORIGINAL_PRECURSOR_SCAN_NO 5329 CONFIDENCE standard compound; INTERNAL_ID 1384; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5339; ORIGINAL_PRECURSOR_SCAN_NO 5335 CONFIDENCE standard compound; INTERNAL_ID 1384; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5308; ORIGINAL_PRECURSOR_SCAN_NO 5303 CONFIDENCE standard compound; INTERNAL_ID 1384; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5337; ORIGINAL_PRECURSOR_SCAN_NO 5334 INTERNAL_ID 1384; DATASET 20200303_ENTACT_RP_MIX506; CONFIDENCE standard compound; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5337; ORIGINAL_PRECURSOR_SCAN_NO 5334 ORIGINAL_ACQUISITION_NO 5351; CONFIDENCE standard compound; INTERNAL_ID 1384; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_PRECURSOR_SCAN_NO 5350 CONFIDENCE standard compound; INTERNAL_ID 1384; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5351; ORIGINAL_PRECURSOR_SCAN_NO 5350
Gly-phe
A dipeptide formed from glycine and L-phenylalanine residues.
Phe-gly
A dipeptide formed from L-phenylalanine and glycine residues.
2-Methyl-2-propanyl 3-(methylamino)-1-azetidinecarboxylate hydroc hloride (1:1)
tert-Butyl 3,4-dihydropyrrolo[1,2-a]pyrazine-2(1H)-carboxylate
tert-butyl N-(azetidin-3-ylmethyl)carbamate hydrochloride
tert-Butyl 3-(aminomethyl)azetidine-1-carboxylate hydrochloride
Ethyl 1-methyl-7-oxo-4,5,6,7-tetrahydro-1H-indazole-3-carboxylate
(2-AMINO-5,6-DIHYDRO-4H-CYCLOPENTA[B]THIOPHEN-3-YL)-(4-CHLORO-PHENYL)-METHANONE
(3-AMINO-2-METHYL-PHENYL)-CARBAMIC ACID TERT-BUTYL ESTER
Poly(3-decylthiophene-2,5-diyl), regioregular Electronic Grade
(Azetidin-3-yl)(methyl)carbamic acid tert-butyl ester hydrochloride
(2S,3S)-3-Amino-N-cyclopropyl-2-hydroxyhexanamide hydrochloride
2-Fluoro-4-(4-methyl-1-piperazinyl)benzaldehyde
C12H15FN2O (222.11683519999997)
3-(Tetramethyl-1,3,2-dioxaborolan-2-yl)-cyclohex-2-enone
(4-AMINO-3-METHYL-PHENYL)-CARBAMIC ACID TERT-BUTYL ESTER
Benzenamine,N-[3-(phenylamino)-2-propen-1-ylidene]-
4-TERT-BUTYL-2-TRIFLUOROMETHYLCYCLOHEXANONE
C11H17F3O (222.12314279999998)
Benzeneacetic acid,4-methoxy-a,a-dimethyl-, ethyl ester
(2-FLUOROPHENYL)(4-METHYLPIPERAZIN-1-YL)METHANONE
C12H15FN2O (222.11683519999997)
(4-AMINO-2-METHYL-PHENYL)-CARBAMIC ACID TERT-BUTYL ESTER
FMOC-(R)-5,5-DIMETHYLTHIAZOLIDINE-4-CARBOXYLIC ACID
2-(2,5-Dimethylfuran-3-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
2-[(2-ethynylimidazol-1-yl)methoxy]ethyl-trimethylsilane
(3S)-3-Amino-N-cyclopropyl-2-hydroxyhexanamide hydrochloride
2-amino-N-(4-methoxyphenyl)-N-propan-2-ylacetamide
3,5-Heptanedione,2,2,6,6-tetramethyl-, ion(1-), potassium (1:1)
tetrahydro-3,3,5,5-tetrakis(hydroxymethyl)pyran-4-ol
1-(2-METHYL-THIAZOL-4-YLMETHYL)-PIPERAZINE DIHYDROCHLORIDE
1-(TRIFLUOROMETHYL)VINYL BORONIC ACID HEXYLENE GLYCOL ESTER
(R)-tert-Butyl 3-aminopyrrolidine-1-carboxylate hydrochloride
5-Norbornene-2-carboxylic tetrahydrofurfuryl ester
3-Fluorophenylboronic Acid Pinacol Ester
C12H16BFO2 (222.12273180000003)
1-(2-methylpropyl)-3,4-dihydro-1H-isochromene-6,7-diol
buta-1,3-diene,N-(hydroxymethyl)-2-methylprop-2-enamide,prop-2-enenitrile
(5-AMINO-2-METHYL-PHENYL)-CARBAMIC ACID TERT-BUTYL ESTER
tert-Butyl 3-aminopyrrolidine-1-carboxylate hydrochloride
Benzenepropanoic acid,a-hydroxy-, 1,1-dimethylethyl ester,(S)-
1H-Indazole-3-carboxylicacid,4,5,6,7-tetrahydro-4-methyl-7-(1-methylethyl)-(9CI)
PIPERIDINE-4-CARBOXYLIC ACID (4-FLUORO-PHENYL)-AMIDE
C12H15FN2O (222.11683519999997)
2,7-dicyano-2,7-dimethyl-3,6-diazaocta-3,5-dien-3,6-dioxide
l-Buthionine sulfoximine
C471 - Enzyme Inhibitor > C2130 - Gamma-Glutamylcysteine Synthetase Inhibitor
(3-((Tetrahydro-2H-pyran-2-yl)oxy)phenyl)boronic acid
2-Methyl-2-propanyl [2-(4-pyridinyl)ethyl]carbamate
2-FLUOROPHENYLBORONIC ACID, PINACOL ESTER
C12H16BFO2 (222.12273180000003)
4-Fluoro-N-(4-piperidinyl)benzamide
C12H15FN2O (222.11683519999997)
4-FLUORO-3-(4-METHYLPIPERAZIN-1-YL)BENZALDEHYDE
C12H15FN2O (222.11683519999997)
1,3-Dioxolane,2,2-dimethyl-4-[(phenylmethoxy)methyl]-
2-(4-fluorophenyl)-4,4,6-trimethyl-1,3,2-dioxaborinate
C12H16BFO2 (222.12273180000003)
(4S,6S)-4H-THIENO[2,3-B]-THIOPYRAN-4-OL-5,6-DIHYDRO-6-METHYL-7,7-DIOXIDE
Hydrazinecarboxylic acid, 2-(phenylmethyl)-, 1,1-dimethylethyl ester
Silane, trimethyl(3,4,6,7-tetrahydro-3,3-dimethylcyclopenta[c]pyran-1-yl)- (9CI)
C13H22OSi (222.14398419999998)
N-methyl-1-[6-(oxan-4-yloxy)pyridin-3-yl]methanamine
4-(1-METHYLETHENYL)-2-PROPYL-1H-IMIDAZOLE-5-CARBOXYLIC ACID ETHYL ESTER
ethyl 4-(methylamino)piperidine-1-carboxylate,hydrochloride
Thiourea, N-ethyl-N-(2,4,6-trimethylphenyl)- (9CI)
1-[3-(Trimethoxysilyl)propyl]urea
C7H18N2O4Si (222.10357879999998)
[2-[[(1R,2R)-1-hydroxy-1-phenylpropan-2-yl]-methylamino]-2-oxoethyl]azanium
2-(2,2-dimethylpropanoylamino)pyridine-3-carboxylic acid
[2-(4-methylpiperazin-1-yl)pyrimidin-5-yl]boronic acid
5-tert-Butyl-4,5,6,7-tetrahydro-1H-indazole-3-carboxylic acid
5-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)pyrimidin-2-ol
(4aR,6aS,9aS,9bS)-6a-methyloctahydrocyclopenta[f]chromene-3,7(2H,8H)-dione
N-(3-Ethyl-2-pyridinyl)carbamic acid tert-butyl ester
N-[2-[(2-HYDROXYETHYL)AMINO]-2-OXOETHYL]BENZENECARBOXAMIDE
2-(4-FLUOROPHENYL)-4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLANE
C12H16BFO2 (222.12273180000003)
(3-FORMYL-2-ISOPROPOXY-5-METHYLPHENYL)BORONIC ACID
Ethanone, 1-[5-methyl-2-[(trimethylsilyl)oxy]phenyl]-
(4-tert-Butylphenoxy)(trimethyl)silane
C13H22OSi (222.14398419999998)
(5-Isopropyl-2-methylphenoxy)trimethylsilane
C13H22OSi (222.14398419999998)
3-Isobutyl-1-methylxanthine
D004791 - Enzyme Inhibitors > D010726 - Phosphodiesterase Inhibitors
morinamide
J - Antiinfectives for systemic use > J04 - Antimycobacterials > J04A - Drugs for treatment of tuberculosis C254 - Anti-Infective Agent > C52588 - Antibacterial Agent > C280 - Antitubercular Agent
nicametate
C78274 - Agent Affecting Cardiovascular System > C29707 - Vasodilating Agent D002317 - Cardiovascular Agents > D014665 - Vasodilator Agents
1D-3-ammmonio-1-guanidiniumyl-1,3-dideoxy-scyllo-inositol(2+)
1-Guanidiniumyl-1-deoxy-scyllo-inositol(1+)
C7H16N3O5+ (222.10899060000003)
Nonylsulfamate
An organic sulfamate oxoanion that is the conjugate base of nonylsulfamic acid. It has been isolated from Daphnia pulex and has been shown to cause morphological changes in the green alga Scenedesmus gutwinskii.
(7-Methyloctyl)sulfamate
An organic sulfamate oxoanion that is the conjugate base of (7-methyloctyl)sulfamic acid. It has been isolated from Daphnia pulex and has been shown to cause morphological changes in the green alga Scenedesmus gutwinskii.
3-(1-Methylpiperidin-1-ium-1-yl)propane-1-sulfonic acid
5-Methoxy-2-methyl-3-(3-methylbut-2-enyl)benzene-1,4-diol
1-Hydroxy-1-(4-methoxyphenyl)-4-methyl-3-pentanone
2-Trimethylsilyloxy-4-phenylbutane
C13H22OSi (222.14398419999998)
Butane, 2-phenyl-3-(trimethylsilyloxy)-
C13H22OSi (222.14398419999998)
5-Trimethylsilylmethyl-2,3,3a,4,7,7a-hexahydro-1H-inden-1-one
C13H22OSi (222.14398419999998)
6-(Trimethylsilylmethyl)-2,3,3a,4,7,7a-hexahydro-1H-inden-1-one
C13H22OSi (222.14398419999998)
Methyl 3-ethyl-4-oxotricyclo(4.3.0.0(1,5))nonane-5-carboxylate
Methyl 2-methyl-4-oxo-tricyclo(5,3,0,0(5,10))decane-1-carboxylate
Dehydrovomifoliol
(6S)-dehydrovomifoliol is a dehydrovomifoliol that has S-configuration at the chiral centre. It has a role as a plant metabolite. It is an enantiomer of a (6R)-dehydrovomifoliol. Dehydrovomifoliol is a natural product found in Psychotria correae, Dendrobium loddigesii, and other organisms with data available.
BUTHIONINE SULFOXIMINE
D020011 - Protective Agents > D011837 - Radiation-Protective Agents D009676 - Noxae > D000963 - Antimetabolites D011838 - Radiation-Sensitizing Agents D000970 - Antineoplastic Agents D004791 - Enzyme Inhibitors
4-hydroxy-3,5,5-trimethyl-4-[(1E)-3-oxobut-1-en-1-yl]cyclohex-2-en-1-one
hexyl salicylate
D000893 - Anti-Inflammatory Agents > D000894 - Anti-Inflammatory Agents, Non-Steroidal > D012459 - Salicylates
2-Hydroxyibuprofen
A hydroxy monocarboxylic acid that is ibuprofen in which the methine proton on the isobutyl group has been replaced by a hydroxy group.
2-(hydroxymethyl)-6-(propan-2-yloxy)oxane-3,4,5-triol
(6S)-dehydrovomifoliol
A dehydrovomifoliol that has S-configuration at the chiral centre.
1-O-isopropyl-beta-D-glucopyranoside
A natural product found in Citrus hystrix.
S-butyl-DL-homocysteine (S,R)-sulfoximine
A sulfoximide that is the sulfoximine derivative of an analogue of DL-methionine in which the S-methyl group is replaced by S-butyl.
4-[(2e,4e)-hexa-2,4-dien-1-yl]-3-[(2s)-2-hydroxypropyl]-5h-furan-2-one
6-[5-(hydroxymethyl)-1-methylpiperidin-3-yl]pyridin-2-ol
(1s,2r,3z,5r)-3-(but-2-yn-1-ylidene)-6-oxaspiro[4.5]decane-1,2-diol
(2r,3s,4s,5r,6r)-3,4-dimethoxy-6-(methoxymethyl)oxane-2,5-diol
5-hydroxy-4,6,6-trimethyl-5-(3-oxobut-1-en-1-yl)cyclohex-3-en-1-one
7,11-dehydromatrine
{"Ingredient_id": "HBIN012860","Ingredient_name": "7,11-dehydromatrine","Alias": "NA","Ingredient_formula": "C12H18N2O2","Ingredient_Smile": "C1CC2CN3C(=C4C2N(C1)CCC4)CCCC3=O","Ingredient_weight": "222.28","OB_score": "44.42628517","CAS_id": "85799-36-6","SymMap_id": "SMIT00644","TCMID_id": "4947","TCMSP_id": "MOL006583","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}