Exact Mass: 350.0879
Exact Mass Matches: 350.0879
Found 500 metabolites which its exact mass value is equals to given mass value 350.0879
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Estrone 3-sulfate
Estrone sulfate is a sulfated estrone derivative. Estrone sulfate acts as a long-lived reservoir that can be converted as needed to the more active estradiol (from estrone via 17 beta-hydroxysteroid dehydrogenase). Estrone Sulfate (E1S) is the most abundant circulating estrogen in non-pregnant women as well as normal men. Estrone is primarily synthesized from estrone sulfate. Estrone is an estrogenic hormone secreted by the ovaries and adipose tissues. Estrone is one of the three estrogens found in humans. The other two are estriol and estradiol. Estrone is the least prevalent of the three. Estradiol plays a critical role on reproductive and sexual functioning in women and it also affects other organs including the bones. Estriol is an estrogen that is prevalent primarily during pregnancy. [HMDB] Estrone sulfate is a sulfated estrone derivative. Estrone sulfate acts as a long-lived reservoir that can be converted as needed to the more active estradiol (from estrone via 17 beta-hydroxysteroid dehydrogenase). Estrone Sulfate (E1S) is the most abundant circulating estrogen in non-pregnant women as well as normal men. Estrone is primarily synthesized from estrone sulfate. Estrone is an estrogenic hormone secreted by the ovaries and adipose tissues. Estrone is one of the three estrogens found in humans. The other two are estriol and estradiol. Estrone is the least prevalent of the three. Estradiol plays a critical role on reproductive and sexual functioning in women and it also affects other organs including the bones. Estriol is an estrogen that is prevalent primarily during pregnancy. C147908 - Hormone Therapy Agent > C548 - Therapeutic Hormone > C1636 - Therapeutic Steroid Hormone C147908 - Hormone Therapy Agent > C548 - Therapeutic Hormone > C483 - Therapeutic Estrogen D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones
Prodiamine
CONFIDENCE standard compound; INTERNAL_ID 498; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5592; ORIGINAL_PRECURSOR_SCAN_NO 5591 CONFIDENCE standard compound; INTERNAL_ID 498; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5630; ORIGINAL_PRECURSOR_SCAN_NO 5629 CONFIDENCE standard compound; INTERNAL_ID 498; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5608; ORIGINAL_PRECURSOR_SCAN_NO 5607 CONFIDENCE standard compound; INTERNAL_ID 498; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5607; ORIGINAL_PRECURSOR_SCAN_NO 5606 CONFIDENCE standard compound; INTERNAL_ID 498; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5619; ORIGINAL_PRECURSOR_SCAN_NO 5616 CONFIDENCE standard compound; INTERNAL_ID 498; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5615; ORIGINAL_PRECURSOR_SCAN_NO 5612
Penicillin V
Penicillin V is narrow spectrum antibiotic used to treat mild to moderate infections caused by susceptible bacteria. It is a natural penicillin antibiotic that is administered orally. Penicillin V may also be used in some cases as prophylaxis against susceptible organisms. Natural penicillins are considered the drugs of choice for several infections caused by susceptible gram positive aerobic organisms, such as Streptococcus pneumoniae, groups A, B, C and G streptococci, nonenterococcal group D streptococci, viridans group streptococci, and non-penicillinase producing staphylococcus. Aminoglycosides may be added for synergy against group B streptococcus (S. agalactiae), S. viridans, and Enterococcus faecalis. The natural penicillins may also be used as first or second line agents against susceptible gram positive aerobic bacilli such as Bacillus anthracis, Corynebacterium diphtheriae, and Erysipelothrix rhusiopathiae. Natural penicillins have limited activity against gram negative organisms; however, they may be used in some cases to treat infections caused by Neisseria meningitidis and Pasteurella. They are not generally used to treat anaerobic infections. Resistance patterns, susceptibility and treatment guidelines vary across regions. J - Antiinfectives for systemic use > J01 - Antibacterials for systemic use > J01C - Beta-lactam antibacterials, penicillins > J01CE - Beta-lactamase sensitive penicillins D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D047090 - beta-Lactams D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D010406 - Penicillins D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D007769 - Lactams C254 - Anti-Infective Agent > C258 - Antibiotic > C260 - Beta-Lactam Antibiotic
Clitidine 5-phosphate
Biapenem
J - Antiinfectives for systemic use > J01 - Antibacterials for systemic use > J01D - Other beta-lactam antibacterials > J01DH - Carbapenems D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D013845 - Thienamycins D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D047090 - beta-Lactams D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D007769 - Lactams C254 - Anti-Infective Agent > C258 - Antibiotic > C260 - Beta-Lactam Antibiotic Same as: D01057
16alpha-Bromo-17beta-estradiol
D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones
Penicillin X
D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D047090 - beta-Lactams D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D010406 - Penicillins D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D007769 - Lactams
6-[2,3-Dihydroxy-1-(hydroxymethyl)propyl]-1,2-dihydro-7-hydroxy-9-methoxy-cyclopenta[c][1]benzopyran-3,4-dione
6-[2,3-Dihydroxy-1-(hydroxymethyl)propyl]-1,2-dihydro-7-hydroxy-9-methoxy-cyclopenta[c][1]benzopyran-3,4-dione is also known as AFBDOH or Aflatoxin b1 trialcohol. 6-[2,3-Dihydroxy-1-(hydroxymethyl)propyl]-1,2-dihydro-7-hydroxy-9-methoxy-cyclopenta[c][1]benzopyran-3,4-dione is considered to be slightly soluble (in water) and acidic
Indole-3-acetohydroximoyl-cysteinylglycine
4'-O-Methylkanzonol W
4-O-Methylkanzonol W is found in herbs and spices. 4-O-Methylkanzonol W is a constituent of Glycyrrhiza glabra (licorice)
3-Feruloyl-1,5-quinolactone
3-Feruloyl-1,5-quinolactone is a polyphenol compound found in foods of plant origin (PMID: 20428313)
4-Feruloyl-1,5-quinolactone
4-Feruloyl-1,5-quinolactone is a polyphenol compound found in foods of plant origin (PMID: 20428313)
8-Chloro-10-[3-(dimethylamino)propyl]phenothiazine-2,3-diol
Biapenem
Sulfuric acid [(13S)-13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl] ester
Fenoxypen
Loviride
C471 - Enzyme Inhibitor > C1589 - Reverse Transcriptase Inhibitor > C97453 - Non-nucleoside Reverse Transcriptase Inhibitor D000890 - Anti-Infective Agents > D000998 - Antiviral Agents > D018894 - Reverse Transcriptase Inhibitors D004791 - Enzyme Inhibitors > D019384 - Nucleic Acid Synthesis Inhibitors C254 - Anti-Infective Agent > C281 - Antiviral Agent
Penicillin X
N-(6-Aminopyridin-2-yl)-4'-cyanobiphenyl-4-sulfonamide
4-(2,6-Dioxo-1-propyl-3,7-dihydropurin-8-yl)benzenesulfonic acid
N-[4-Cloro-3-(T-butyloxome)phenyl-2-methyl-3-furan-carbothiamide
leiocarpin
Neorautenane
Semiglabrinol
Pseudosemiglabrinol
4-O-methylalpinumisoflavone
5-methoxy-3-methyl-3,4-methylenedioxyfurano(2,3:7,8)flavone
(-)-Epiafzelechin-4-(2-hydroxyethyl)thio ether|(-)-epiafzerechin 4-(2-hydroxyethyl)thio ether
3,4-dimethoxy-3,4-methylenedioxy-9-oxo-Delta7,8,7,8-6.7,8.8-neolignan
4-O-methylatalantoflavone|5-hydroxy-2-(4-methoxyphenyl)-8,8-dimethyl-pyrano[2,3-f]chromen-4-one
2-bromo-3-chlorobisabola-7(14),11-diene-6,10-diol|rel-(alpha,1R,3S,4S)-3-bromo-4-chloro-1-hydroxy-4-methyl-delta-methylene-alpha-(1-methylethenyl)cyclohexanebutanol
benzyl beta-D-glucopyranoside-4-O-sulfate|sulfatricalysine E
10-(1,3-Benzodioxole-5-yl)-6,10-dihydrofuro[3,4:6,7]naphtho[1,2-d]-1,3-dioxole-9(7H)-one
GLYCYRRHIZOL B
An organic heteropentacyclic compound that is 2H-pyrano[3,4,5,6]-pterocarpene substituted by a hydroxy group at position 7, a methoxy group at position 5 and geminal methyl groups at position 2. Isolated from the roots of Glycyrrhiza uralensis, it exhibits antibacterial activity.
Lespeflorin H2
A member of the class of coumestans that is 9,10-dihydro-6H-[1]benzofuro[3,2-c]chromene substituted by a methoxy group at position 3, a hydroxy group at position 8 and a 6,6-dimethyl-3,6-dihydro-2H-pyran ring fused across positions 9 and 10. Isolated from the roots of Lespedeza floribunda, it acts as a melanin synthesis inhibitor.
5,7-dihydroxy-2-(1-hydroxy-2,6-dimethoxy-4-oxocyclohexyl)chromen-4-one
3,4-Methylenedioxy-7-hydroxy-6-isopentenyl flavone
(9E,17E)-form-18-Bromo-9,17-octadecadiene-5,7,-diynoic acid
3-methoxy-1,4,9-trihydroxy-1,2,3,6b-tetrahydrobenzo[j]fluoranthen-8(7H)-one|hypoxylonol B
4,10-dibromo-4-chloro-3,11,11-trimethyl-7-methylidenespiro[5.5]undec-3,9-diol|dendroidiol
2-hydroxy-6,6-dimethylpyrano-[2,3:4,3]-3,4-methylenedioxychalcone|2-hydroxy-6,6-dimethylpyrano[2,3:4,3]-3,4-methylenedioxychalcone|3,4-methylenedioxy-2-hydroxy-6,6-dimethylchromeno-[2,3:4,3]-chalcone|Glabrachromen-II|Glabrachromene II
rel-(1R,3S,4S)-4-bromo-3-chloro-1-(5-hydroxy-6-methylhepta-1,6-dien-2-yl)-4-methylcyclohexanol|rel-(2S,3S,6R)-3-bromo-2-chloro-2,3-dihydro-6,10-dihydroxy-beta-bisabolene
(-)1,6 desoxypipoxide|(-)1,6-Desoxypipoxide|(2R)-trans-3-(benzoyloxy)-1-<(benzoyloxy)methyl>-2-hydroxycyclohexa-4,6-diene|1,6-desoxypipoxide|deoxypipoxide
5-(1,3-Benzodioxole-5-yl)-5,9-dihydrofuro[3,4:6,7]naphtho[2,3-d]-1,3-dioxole-6(8H)-one
5-(3-Methoxy-4-hydroxyphenyl)furo[3,4:6,7]naphtho[2,3-d][1,3]dioxole-6(8H)-one
8-Ethyl-1,6,10,11-tetrahydroxy-5,12-naphthacenedione
2,2,9-Trimethyl-5-methoxy-11-hydroxy-2H-anthra[1,2-b]pyran-7,12-dione
ethyl 2,4-dihydroxy-3-((3,4,5-trihydroxybenzoyl)oxy)-benzoate
palmarumycin C12|palmarumycins C12|[18-O2]palmarumycin C12
Coumarin VI
Coumarin 6 is a member of 7-aminocoumarins. It has a role as a fluorochrome. Coumarin 6 is a natural product found in Ferula fukanensis with data available.
Ranitidine hydrochloride
D018377 - Neurotransmitter Agents > D018494 - Histamine Agents > D006633 - Histamine Antagonists D005765 - Gastrointestinal Agents > D000897 - Anti-Ulcer Agents Ranitidine hydrochloride is a potent, selective and orally active histamine H2-receptor antagonist with an IC50 of 3.3 μM that inhibits gastric secretion. Ranitidine hydrochloride is a weak inhibitor of CYP2C19 and CYP2C9[1][2].
2-Methoxy-1-methyl-3-(1-methyl-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl)-1H-benzo[f]indole-4,9-dione
methyl 2-(4a,6,10a-trihydroxy-1-methyl-5,10-dioxo-3,4-dihydro-1H-benzo[g]isochromen-3-yl)acetate
C17H15ClO6_7-Chloro-2,4,6-trimethoxy-6-methyl-3H,4H-spiro[1-benzofuran-2,1-cyclohexa[2,5]diene]-3,4-dione
methyl 2-(4a,6,10a-trihydroxy-1-methyl-5,10-dioxo-3,4-dihydro-1H-benzo[g]isochromen-3-yl)acetate
methyl 2-(4a,6,10a-trihydroxy-1-methyl-5,10-dioxo-3,4-dihydro-1H-benzo[g]isochromen-3-yl)acetate_major
Ala Ala Cys Ser
Ala Ala Ser Cys
Ala Cys Ala Ser
Ala Cys Gly Thr
Ala Cys Ser Ala
Ala Cys Thr Gly
Ala Gly Cys Thr
Ala Gly Thr Cys
Ala Ser Ala Cys
Ala Ser Cys Ala
Ala Thr Cys Gly
Ala Thr Gly Cys
Cys Ala Ala Ser
Cys Ala Gly Thr
Cys Ala Ser Ala
Cys Ala Thr Gly
Cys Asp Gly Gly
Cys Gly Ala Thr
Cys Gly Asp Gly
Cys Gly Gly Asp
Cys Gly Thr Ala
Cys Ser Ala Ala
Cys Thr Ala Gly
Cys Thr Gly Ala
Asp Cys Gly Gly
Asp Gly Cys Gly
Asp Gly Gly Cys
Gly Ala Cys Thr
Gly Ala Thr Cys
Gly Cys Ala Thr
Gly Cys Asp Gly
Gly Cys Gly Asp
Gly Cys Thr Ala
Gly Asp Cys Gly
Gly Asp Gly Cys
Gly Gly Cys Asp
Gly Gly Asp Cys
Gly Gly Met Ser
Gly Gly Ser Met
Gly Met Gly Ser
Gly Met Ser Gly
Gly Ser Gly Met
Gly Ser Met Gly
Gly Thr Ala Cys
Gly Thr Cys Ala
Met Gly Gly Ser
Met Gly Ser Gly
Met Ser Gly Gly
Idebenone Metabolite (Benzenebutanoic acid, 2-hydroxy-3,4-dimethoxy-6-methyl-5-(sulfooxy)-)
3-Feruloylquinic acid lactone
4-Feruloylquinic acid lactone
4'-O-Methylkanzonol W
Methyl (4a,6,10a-trihydroxy-1-methyl-5,10-dioxo-3,4,4a,5,10,10a-hexahydro-1H-benzo[g]isochromen-3-yl)acetate
estrone sulfate
C147908 - Hormone Therapy Agent > C548 - Therapeutic Hormone > C1636 - Therapeutic Steroid Hormone C147908 - Hormone Therapy Agent > C548 - Therapeutic Hormone > C483 - Therapeutic Estrogen D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones
1,3,4,6-TETRA-O-ACETYL-2-DEOXY-2-FLUORO-ALPHA-D-GALACTOPYRANOSE
1,2,3,4-TETRA-O-ACETYL-6-DEOXY-6-FLUORO-ALPHA-D-GLUCOPYRANOSE
4-(3,3-BIS(2-METHOXYETHYL)UREIDO)BENZENE-1-SULFONYL CHLORIDE
1,2,4,6-TETRA-O-ACETYL-3-DEOXY-3-FLUORO-ALPHA-D-GLUCOPYRANOSE
1-bromo-4-[3-[(2-methoxyphenyl)methoxy]propoxy]benzene
1,3,4-Thiadiazole-2(3H)-thione, 5-(tert-dodecyldithio)-
bis-(Acetylactonate) ethoxide isopropoxide titanium
4,4,5,5-TETRAMETHYL-2-(2-METHYL-5-((TRIFLUOROMETHYL)SULFONYL)PHENYL)-1,3,2-DIOXABOROLANE
Disiloxane, 1,3-bis(3-chloropropyl)-1,1,3,3-tetramethoxy-
4-DIMETHYLAMINO-7-(4-ETHYL-PHENYL)-7H-9-THIA-1,5,7-TRIAZA-FLUOREN-8-ONE
1,2,3,4-TETRA-O-ACETYL-6-DEOXY-6-FLUORO-ALPHA-D-GALACTOPYRANOSE
(3,4,5-triacetyloxy-6-fluorooxan-2-yl)methyl acetate
ethoxybis(pentane-2,4-dionato-O,O)(propan-2-olato)titanium
METHYL 5-CYANO-2-(DIMETHOXYMETHYL)-6-(2,2,2-TRIFLUOROETHYLTHIO)NICOTINATE
1,2-Benzenediamine, 4-(4-methyl-1-piperazinyl)-, tetrahydrochloride
(diisopropoxyphosphoryl)methyl 4-methylbenzenesulfonate
2,3,4,6-tetra-o-acetyl-alpha-d-glucopyranosyl fluoride
[(2R,3S,4S,5R,6R)-3,4,5-triacetyloxy-6-fluorooxan-2-yl]methyl acetate
(3-chloropropyl)diphenylsulfonium tetrafluoroborate
(3aR,4R,5R,6aS)-4-Formyl-2-oxohexahydro-2H-cyclopenta[b]furan-5-y l 4-biphenylcarboxylate
N-(2,4-dimethylphenyl)-2,2,2-trifluoro-N-[(E)-(3-methoxyphenyl)methylideneamino]acetamide
N-[4-Cloro-3-(T-butyloxome)phenyl-2-methyl-3-furan-carbothiamide
alpha-(2,6-Dichlorophenyl)-alpha-(2-acetyl-5-methylanilino)acetamide
Raxatrigine hydrochloride
C78272 - Agent Affecting Nervous System > C241 - Analgesic Agent
N-(6-Aminopyridin-2-yl)-4-cyanobiphenyl-4-sulfonamide
4-(2,6-Dioxo-1-propyl-3,7-dihydropurin-8-yl)benzenesulfonic acid
D018377 - Neurotransmitter Agents > D058905 - Purinergic Agents > D058914 - Purinergic Antagonists PSB-1115 is a selective A2B Adenosine Receptor antagonist. PSB-1115 inhibits the 2,4,6-trinitrobenzenesulfonic acid (TNBS)-induced contraction inhibition of acetylcholine (ACh)[1].
N,N-dimethylsulfamic acid [3-[(4-methoxyanilino)-oxomethyl]phenyl] ester
1,4-Diamino-2,3-dicyano-1,4-bis(phenylthio)butadiene
5-Methyl-2-[[(4-nitrophenyl)-oxomethyl]hydrazo]-4-thiazolecarboxylic acid ethyl ester
N-[4-[(3,4-dimethoxyphenyl)sulfamoyl]phenyl]acetamide
2-(2-((E)-2-((E)-(2-hydroxybenzylidene)hydrazono)-4-oxothiazolidin-5-yl)acetamido)acetic acid
4-Methyl-5-{[(3-methylbenzoyl)oxy]ethanimidoyl}-2-phenyl-1,3-thiazole
8-methyl-6-(3-methyl-2-thiophenyl)-4-oxo-3,6-dihydro-2H-pyrimido[2,1-b][1,3]thiazine-7-carboxylic acid ethyl ester
Tert-butyl 2-(5-chloro-2,2-dioxospiro[indole-3,3-pyrrolidine]-1-yl)acetate
2-[(4-Ethynyl-2-Fluorophenyl)amino]-3,4-Difluoro-N-(2-Hydroxyethoxy)benzamide
4-(2,4-Dimethyl-1,3-thiazol-5-YL)-N-[4-(trifluoromethyl)phenyl]pyrimidin-2-amine
N~2~-(Biphenyl-4-Ylsulfonyl)-N-Hydroxy-N~2~-(2-Hydroxyethyl)glycinamide
2-O-Methyl-3-Methyl-3-Deoxy-Arabinofuranosyl-Thymine-5-Phosphate
Loviride
C471 - Enzyme Inhibitor > C1589 - Reverse Transcriptase Inhibitor > C97453 - Non-nucleoside Reverse Transcriptase Inhibitor D000890 - Anti-Infective Agents > D000998 - Antiviral Agents > D018894 - Reverse Transcriptase Inhibitors D004791 - Enzyme Inhibitors > D019384 - Nucleic Acid Synthesis Inhibitors C254 - Anti-Infective Agent > C281 - Antiviral Agent
6-[[2-(4-Hydroxyphenyl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
{[(2R)-2-azaniumyl-3-{[(1E)-N-hydroxy-2-(1H-indol-3-yl)ethanimidoyl]sulfanyl}propanoyl]amino}acetate
2-Carbamoyl-3,10,11,12-tetrahydroxytetracen-1-olate
(2S,4S,5R,6R)-5-acetamido-4-acetyloxy-2-hydroxy-6-(1,2,3-trihydroxypropyl)oxane-2-carboxylate
(2S,5R)-5-acetamido-6-[(1S)-3-acetyloxy-1,2-dihydroxypropyl]-2,4-dihydroxyoxane-2-carboxylate
2-Oxo-3-(phosphooxy)propyl 8-methyl-3-oxodecanoate
Alquen
D018377 - Neurotransmitter Agents > D018494 - Histamine Agents > D006633 - Histamine Antagonists D005765 - Gastrointestinal Agents > D000897 - Anti-Ulcer Agents
benzoic acid 2-[(2S)-7-oxo-2,3-dihydrofuro[3,2-g][1]benzopyran-2-yl]propan-2-yl ester
Brasiliquinone C
A carbopolycyclic compound that is 3,4-dihydrotetraphene-1,7,12(2H)-trione substituted by hydroxy groups at positions 6 and 8 and an ethyl group at position 3 (the S stereoisomer). It is isolated from the culture broth of Nocardia brasiliensis and exhibits antibacterial activity against Gram-positive bacteria. It is also active against the multiple drug-resistant P388/ADR tumour cells.
Sulfuric acid [(13S)-13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl] ester
2-fluoro-N-[2-(4-fluorophenyl)-1,3-benzoxazol-5-yl]benzamide
1-(4-Fluorophenyl)sulfonyl-4-(2-methoxyphenyl)piperazine
6-Amino-3-(3-methoxyphenyl)-4-(3-thiophenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
3-((E)-3-Benzo[1,3]dioxol-5-yl-acryloylamino)-1H-indole-2-carboxylic acid
3-Chloro-1-(2,5-dimethoxyphenyl)-4-(1-piperidinyl)pyrrole-2,5-dione
4-chloro-N-[3-chloro-4-(4-morpholinyl)phenyl]benzamide
N-[4-(1-pyrrolidinylsulfonyl)phenyl]-2-thiophen-2-ylacetamide
5-nitro-N-[4-(2-oxazolo[4,5-b]pyridinyl)phenyl]-2-furancarboxamide
6-(3,5-dimethyl-4-isoxazolyl)-N-[(3-methyl-2-thiophenyl)methyl]-4-quinazolinamine
1-(4-Fluorophenyl)-3-(2-methoxy-3-dibenzofuranyl)urea
1-[2-[(4-Chlorophenyl)thio]ethyl]-3-(2,4-dimethylphenyl)thiourea
N-[4-[[2-furanyl(oxo)methyl]amino]phenyl]-1,3-benzodioxole-5-carboxamide
3-(1,3-benzodioxol-5-yl)-N-(4-phenyl-1,3-thiazol-2-yl)acrylamide
7-Amino-9-(phenacylthio)-8-azaspiro[4.5]deca-6,9-diene-6,10-dicarbonitrile
3-(2,3-dimethyl-1H-indol-5-yl)-4-(3-methoxyphenyl)-1H-1,2,4-triazole-5-thione
N-(4-chlorophenyl)-5-methyl-3-(phenylmethyl)-7-triazolo[4,5-d]pyrimidinamine
N-[2-methyl-5-(3-methyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]-3-pyridinecarboxamide
N-(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-methyl-4-nitro-3-isoxazolecarboxamide
methyl N-[(E)-(2-piperidin-1-yl-4-thiophen-2-yl-1,3-thiazol-5-yl)methylideneamino]carbamate
(5R,6R)-3,3-dimethyl-7-oxo-6-[(2-phenoxyacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
11beta,13-Dihydrolactucin 15-oxalate
A sesquiterpene lactone obtained by formal condensation of one of the carboxy groups of oxalic acid with the 15-hydroxy group of 11beta,13-dihydrolactucin. Found in chicory.
1-[1-[(4-Chlorophenyl)methyl]-4-pyrazolyl]-3-(2-oxolanylmethyl)thiourea
4-acetyl-N-(4-chloro-2,5-dimethoxyphenyl)-3,5-dimethyl-1H-pyrrole-2-carboxamide
(Z,2Z)-4-amino-2-[amino(phenylsulfanyl)methylidene]-3-isocyano-4-phenylsulfanylbut-3-enenitrile
5-[(4-Amino-5-methoxy-2-methylphenyl)diazenyl]-2-methoxybenzene-1-sulfonate
sulfuric acid [(8R,9R,13S,14R)-13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl] ester
N-[4-[2-[(2E)-2-(1-phenylethylidene)hydrazinyl]-1,3-thiazol-4-yl]phenyl]acetamide
3,4,5-Trihydroxy-6-(3,4,5-trihydroxycyclohexene-1-carbonyl)oxyoxane-2-carboxylic acid
3,4-dihydroxy-5-[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxycyclohexene-1-carboxylic acid
1-(3-chlorophenyl)-3-[(Z)-[3-hydroxy-5-(hydroxymethyl)-2-methylpyridin-4-yl]methylideneamino]thiourea
(5S,6R)-3,3-dimethyl-7-oxo-6-[(2-phenoxyacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
2-methoxy-1-methyl-3-(1-methyl-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl)-1H-benzo[f]indole-4,9-dione
7,10-Dihydroxyspiro[11-oxatricyclo[4.4.1.01,6]undeca-3,8-diene-5,3-2,4-dioxatricyclo[7.3.1.05,13]trideca-1(12),5,7,9(13),10-pentaene]-2-one
Penicillin V
J - Antiinfectives for systemic use > J01 - Antibacterials for systemic use > J01C - Beta-lactam antibacterials, penicillins > J01CE - Beta-lactamase sensitive penicillins D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D047090 - beta-Lactams D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D010406 - Penicillins D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D007769 - Lactams C254 - Anti-Infective Agent > C258 - Antibiotic > C260 - Beta-Lactam Antibiotic
6-[2,3-Dihydroxy-1-(hydroxymethyl)propyl]-1,2-dihydro-7-hydroxy-9-methoxy-cyclopenta[c][1]benzopyran-3,4-dione
3,3-Dimethyl-7-oxo-6-[(phenoxyacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
8-Chloro-10-[3-(dimethylamino)propyl]phenothiazine-2,3-diol
Phenoxymethylpenicillin
A penicillin compound having a 6beta-(phenoxyacetyl)amino side-chain.
aflatoxin B1 triol
An organic heterotricyclic compound obtained by oxidative cleavage of the furofuran ring system of aflatoxin B1.
5-LOX-IN-1
5-LOX-IN-1 (compound 2b) is an inhibitor of human 5-Lipoxygenase (5-LOX) with an IC50 value of 2.3 μM. 5-LOX-IN-1 can be used for the research of inflammation[1].
DMCM (hydrochloride)
DMCM hydrochloride is a nonselective full inverse agonist of benzodiazepine. DMCM shows bnding afinity at human recombinant GABAA αxβ3γ2 receptor subtypes with Kis of 10 nM, 13 nM, 7.5 nM, 2.2 nM for α1, α2, α3, and α5 ?receptors, respectively[1].
DREADD agonist 21 (dihydrochloride)
DREADD agonist 21 dihydrochloride is a potent human muscarinic acetylcholine M3 receptors (hM3Dq) agonist (EC50=1.7 nM)[1].
6-[2-(2-isopropyl-1,3-thiazol-4-yl)-1,3-thiazol-4-yl]-4-methoxy-3-methylhex-5-en-2-one
3,11,15,18-tetrahydroxy-17-methyl-8-oxapentacyclo[10.6.2.0²,⁷.0⁹,¹⁹.0¹⁶,²⁰]icosa-1(19),2,4,6,9,11,14,16(20)-octaen-13-one
5,14-dihydroxy-15-(3-methylbut-2-en-1-yl)-8,17-dioxatetracyclo[8.7.0.0²,⁷.0¹¹,¹⁶]heptadeca-1(10),2,4,6,11,13,15-heptaene-4-carbaldehyde
(9e,17e)-18-bromooctadeca-9,17-dien-5,7-diynoic acid
1,1'-dioxo-2h,2'h,3h,3'h-[4,4'-biindene]-7,7'-dicarboxylic acid
(3r)-3,4-dimethoxy-6'-methyl-3h-3'-oxaspiro[2-benzofuran-1,2'-tricyclo[6.3.1.0⁴,¹²]dodecane]-1'(12'),4',6',8',10'-pentaen-11'-ol
(17r,18s)-3,11,15,18-tetrahydroxy-17-methyl-8-oxapentacyclo[10.6.2.0²,⁷.0⁹,¹⁹.0¹⁶,²⁰]icosa-1(19),2,4,6,9,11,14,16(20)-octaen-13-one
10-(2h-1,3-benzodioxol-5-yl)-4,6,13-trioxatetracyclo[7.7.0.0³,⁷.0¹¹,¹⁵]hexadeca-1,3(7),8,10-tetraen-12-one
2-(3-bromo-4-chloro-4-methylcyclohexyl)-2,6,6-trimethyl-3h-pyran-3-ol
1,4,9,12a-tetrahydroxy-2,12b-dihydro-1h-perylene-3,10-dione
4,5,14-trihydroxy-15-(hydroxymethyl)-4,7,12-trimethyl-2,9-dioxatricyclo[9.4.0.0³,⁸]pentadeca-1(15),7,11,13-tetraene-6,10-dione
(2r,4s,10r,16r)-16-(furan-3-yl)-18-methyl-3,8,15-trioxapentacyclo[9.7.0.0²,⁴.0⁶,¹⁰.0¹³,¹⁷]octadeca-1(11),5,12,17-tetraene-7,14-dione
(1r,11r)-6-hydroxy-2,12,21-trioxahexacyclo[9.9.1.1¹,¹³.1³,⁷.0¹¹,²³.0¹⁷,²²]tricosa-3,5,7(23),13,15,17(22)-hexaene-8,18-dione
3-ethyl-6-hydroxy-8-methoxy-3,4-dihydro-2h-tetraphene-1,7,12-trione
(2s,4r)-4,5,10-trihydroxy-2-[(2s)-2-hydroxypropyl]-8-methoxy-2h,3h,4h-naphtho[2,3-b]pyran-6,9-dione
16-(2h-1,3-benzodioxol-5-yl)-3,5,13-trioxatetracyclo[7.7.0.0²,⁶.0¹¹,¹⁵]hexadeca-1,6,8,15-tetraen-14-one
(1s,3s,4s)-4-bromo-3-chloro-1-[(5r)-5-hydroxy-6-methylhepta-1,6-dien-2-yl]-4-methylcyclohexan-1-ol
(1r,6s,13r)-6-(prop-1-en-2-yl)-7,11,17,19,23-pentaoxahexacyclo[11.10.0.0²,¹⁰.0⁴,⁸.0¹⁴,²².0¹⁶,²⁰]tricosa-2(10),3,8,14,16(20),21-hexaene
(1r,2s,3r,4s)-1,2,3,4,5-pentahydroxy-7-methoxy-2,8-dimethyl-3,4-dihydro-1h-anthracene-9,10-dione
methyl (1s,3r)-6-hydroxy-1,7-dimethoxy-3-methyl-10-oxo-1h,3h,4h-pyrano[4,3-b]chromene-9-carboxylate
1,6,9-trihydroxy-7ah,8ah,8bh,8ch,9h,10h-peryleno[1,2-b]oxirene-7,11-dione
3',4',7-trihydroxy-6-prenylflavone; 3',4'-methylene ether
{"Ingredient_id": "HBIN007317","Ingredient_name": "3',4',7-trihydroxy-6-prenylflavone; 3',4'-methylene ether","Alias": "NA","Ingredient_formula": "C21H18O5","Ingredient_Smile": "NA","Ingredient_weight": "350.36","OB_score": "NA","CAS_id": "126622-44-4","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "8303","PubChem_id": "NA","DrugBank_id": "NA"}