Exact Mass: 334.0954

Exact Mass Matches: 334.0954

Found 208 metabolites which its exact mass value is equals to given mass value 334.0954, within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error 0.001 dalton.

Mukurozidiol

7H-Furo(3,2-g)(1)benzopyran-7-one, 9-(2,3-dihydroxy-3-methylbutoxy)-4-methoxy-, (R)-

C17H18O7 (334.1052)


Constituent of Japanese drug byakusi obtained from Angelica subspecies Also from lemon oil and other Citrus subspecies [DFC]. (R)-Byakangelicin is found in lemon, citrus, and herbs and spices. Byakangelicin is a member of psoralens. Byakangelicin is a natural product found in Murraya koenigii, Triphasia trifolia, and other organisms with data available. (S)-Byakangelicin is found in herbs and spices. (S)-Byakangelicin is a constituent of common rue (Ruta graveolens). D011838 - Radiation-Sensitizing Agents > D017319 - Photosensitizing Agents > D011564 - Furocoumarins (Rac)-Byakangelicin is a racemate of Byakangelicin mainly isolated from the genus Angelica. Byakangelicin is an aldose-reductase inhibitor with an IC50 value of 6.2 μM[1]. (Rac)-Byakangelicin is a racemate of Byakangelicin mainly isolated from the genus Angelica. Byakangelicin is an aldose-reductase inhibitor with an IC50 value of 6.2 μM[1]. Byakangelicin, one of the active compounds found in the roots of Angelica gigas, can serve as a modulator to improve brain accumulation of diverse active compounds (Umb, Cur, and Dox) and enhance therapeutic effects[1]. Byakangelicin is likely to increase the expression of all PXR target genes (such as MDR1) and induce a wide range of agent-agent interactions. Byakangelicin can inhibit the effects of sex hormones, it may increase the catabolism of endogenous hormones[2]. Byakangelicin, one of the active compounds found in the roots of Angelica gigas, can serve as a modulator to improve brain accumulation of diverse active compounds (Umb, Cur, and Dox) and enhance therapeutic effects[1]. Byakangelicin is likely to increase the expression of all PXR target genes (such as MDR1) and induce a wide range of agent-agent interactions. Byakangelicin can inhibit the effects of sex hormones, it may increase the catabolism of endogenous hormones[2].

   

Penicillin G

(2S,5R,6R)-3,3-dimethyl-7-oxo-6-(2-phenylacetamido)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid

C16H18N2O4S (334.0987)


Penicillin G is narrow spectrum antibiotic used to treat infections caused by susceptible bacteria. It is a natural penicillin antibiotic that is administered intravenously or intramuscularly due to poor oral absorption. Penicillin G 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 S - Sensory organs > S01 - Ophthalmologicals > S01A - Antiinfectives > S01AA - Antibiotics 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

   

Chlorpromazine-N-oxide

3-(2-chloro-10H-phenothiazin-10-yl)-N,N-dimethylpropanamine oxide

C17H19ClN2OS (334.0907)


Chlorpromazine-N-oxide is a metabolite of chlorpromazine. Chlorpromazine (as chlorpromazine hydrochloride, abbreviated CPZ; marketed in the United States as Thorazine and elsewhere as Largactil) is a typical antipsychotic. First synthesized on December 11, 1950, chlorpromazine was the first drug developed with specific antipsychotic action, and would serve as the prototype for the phenothiazine class of drugs, which later grew to comprise several other agents. (Wikipedia)

   
   

Triphenyltetrazolium chloride

2,3,5-Triphenyltetrazolium chloride

C19H15N4. Cl (334.0985)


D019995 - Laboratory Chemicals > D007202 - Indicators and Reagents > D013778 - Tetrazolium Salts D004396 - Coloring Agents

   

(S)-a-Amino-2,5-dihydro-5-oxo-4-isoxazolepropanoic acid N2-glucoside

2-amino-3-{5-oxo-2-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-2,5-dihydro-1,2-oxazol-4-yl}propanoic acid

C12H18N2O9 (334.1012)


(S)-a-Amino-2,5-dihydro-5-oxo-4-isoxazolepropanoic acid N2-glucoside is found in pulses. (S)-a-Amino-2,5-dihydro-5-oxo-4-isoxazolepropanoic acid N2-glucoside is isolated from Pisum sativum (peas Isolated from Pisum sativum (peas). (S)-a-Amino-2,5-dihydro-5-oxo-4-isoxazolepropanoic acid N2-glucoside is found in pulses and common pea.

   

hydroxychlorpromazine

8-chloro-10-[3-(dimethylamino)propyl]-10H-phenothiazin-3-ol

C17H19ClN2OS (334.0907)


hydroxychlorpromazine is a metabolite of chlorpromazine. Chlorpromazine (as chlorpromazine hydrochloride, abbreviated CPZ; marketed in the United States as Thorazine and elsewhere as Largactil) is a typical antipsychotic. First synthesized on December 11, 1950, chlorpromazine was the first drug developed with specific antipsychotic action, and would serve as the prototype for the phenothiazine class of drugs, which later grew to comprise several other agents. (Wikipedia)

   

Progabide

4-{[(4-chlorophenyl)[(1E)-3-fluoro-6-oxocyclohexa-2,4-dien-1-ylidene]methyl]amino}butanimidate

C17H16ClFN2O2 (334.0884)


Progabide is an analog and prodrug of gamma-aminobutyric acid. It is commonly used in the treatment of epilepsy. It has agonistic activity for both the GABAA and GABAB receptors. Progabide has been investigated for many diseases besides epilepsy, including Parkinsons disease, schizophrenia, clinical depression and anxiety disorder with varying success. Progabide is a gamma-aminobutyric acid receptor (GABA) agonist.

   

2-Methoxy-N-[2-(4-sulfamoylphenyl)ethyl]benzamide

2-Methoxy-N-[2-(4-sulphamoylphenyl)ethyl]benzamide

C16H18N2O4S (334.0987)


   

Valine, 3-mercapto-N-((5-oxo-2-(phenylmethyl)-4(5H)-oxazolylidene)methyl)-

2-{[(2-benzyl-5-hydroxy-1,3-oxazol-4-yl)methylidene]amino}-3-methyl-3-sulfanylbutanoic acid

C16H18N2O4S (334.0987)


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

   

Chlorpromazine sulfoxide

2-chloro-10-[3-(dimethylamino)propyl]-10H-5lambda4-phenothiazin-5-one

C17H19ClN2OS (334.0907)


   

2-(1,3-Dioxo-1,3-dihydro-isoindol-2-yl)-3-(1H-indol-3-yl)-propionic acid

2-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)-3-(1H-indol-3-yl)propanoic acid

C19H14N2O4 (334.0954)


   

Pentids

6-[(1-Hydroxy-2-phenylethylidene)amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate

C16H18N2O4S (334.0987)


   

Divaricatol

Divaricatol

C17H18O7 (334.1052)


   

Melampodin B

Melampodin B

C17H18O7 (334.1052)


   

Scandenolide

Scandenolide

C17H18O7 (334.1052)


   
   

(-)-Zinaflavin F

(-)-Zinaflavin F

C17H18O7 (334.1052)


   

6-Methoxydihydrolindbladione

6-Methoxydihydrolindbladione

C17H18O7 (334.1052)


   

CHEMBL487398

CHEMBL487398

C17H18O7 (334.1052)


   

deoxyerythrostominol

deoxyerythrostominol

C17H18O7 (334.1052)


   

Epimesquitol-4alpha-ol 4-ethyl ether

(2R,3R,4R) -3,4,7,8,3,4-Hexahydroxyflavan 4-ethyl ether

C17H18O7 (334.1052)


   

cis-3,4-dihydro-2-(4-hydroxy-3,5-dimethoxyphenyl)-2H-1-Benzopyran-3,5,7-triol

cis-3,4-dihydro-2-(4-hydroxy-3,5-dimethoxyphenyl)-2H-1-Benzopyran-3,5,7-triol

C17H18O7 (334.1052)


   

Mesquitol-4beta-ol 3,8-dimethyl ether

(2R,3S,4S) -4,7,3,4-Tetrahydroxy-3,8-dimethoxyflavan

C17H18O7 (334.1052)


   

Maybridge3_006220

Maybridge3_006220

C16H18N2O4S (334.0987)


   

Ventiloquinone K

Ventiloquinone K

C17H18O7 (334.1052)


   

Altersolanol G

Altersolanol G

C17H18O7 (334.1052)


   

(3R*,4R*)-3-(3,4-dihydroxybenzyl)-3,7,8-trihydroxy-4-methoxychroman|4-O-methylepihaematoxylol

(3R*,4R*)-3-(3,4-dihydroxybenzyl)-3,7,8-trihydroxy-4-methoxychroman|4-O-methylepihaematoxylol

C17H18O7 (334.1052)


   

(2R,3R,4R)-2,3-cis-3,4-cis-4-ethoxy-3,3,4,7,8-pentahydroxyflavan|4-Me ether-(2R,3R,4R)-3,3,4,4,7,8-Hexahydroxyflavan

(2R,3R,4R)-2,3-cis-3,4-cis-4-ethoxy-3,3,4,7,8-pentahydroxyflavan|4-Me ether-(2R,3R,4R)-3,3,4,4,7,8-Hexahydroxyflavan

C17H18O7 (334.1052)


   

Nanaomycin alphaB

Nanaomycin alphaB

C17H18O7 (334.1052)


   

3-acetoxymikaperiplocolide

3-acetoxymikaperiplocolide

C17H18O7 (334.1052)


   

5alpha,6beta,7alpha,8beta-tetrahydroxy-2-<2-(2-hydroxyphenyl)ethyl>-5,6,7,8-tetrahydrochromone|5alpha,6beta,7alpha,8beta-tetrahydroxy-2-[2-(2-hydroxyphenyl)ethyl]-5,6,7,8-tetrahydrochromone|5??,6??,7??,8??-Tetrahydroxy-2-[2-(2-hydroxyphenyl)ethyl]-5,6,7,8-tetrahydrochromone

5alpha,6beta,7alpha,8beta-tetrahydroxy-2-<2-(2-hydroxyphenyl)ethyl>-5,6,7,8-tetrahydrochromone|5alpha,6beta,7alpha,8beta-tetrahydroxy-2-[2-(2-hydroxyphenyl)ethyl]-5,6,7,8-tetrahydrochromone|5??,6??,7??,8??-Tetrahydroxy-2-[2-(2-hydroxyphenyl)ethyl]-5,6,7,8-tetrahydrochromone

C17H18O7 (334.1052)


   

Ventiloquinone D|ventiloquinone-D

Ventiloquinone D|ventiloquinone-D

C17H18O7 (334.1052)


   

Salmoquinone

Salmoquinone

C17H18O7 (334.1052)


   
   

heraclecol|Heraclesol

heraclecol|Heraclesol

C17H18O7 (334.1052)


   

Acutotrinol

Acutotrinol

C17H18O7 (334.1052)


   

6-[2-(4,6-Dimethoxy-benzo[1,3]dioxol-5-yl)-ethyl]-4-methoxy-pyran-2-one

6-[2-(4,6-Dimethoxy-benzo[1,3]dioxol-5-yl)-ethyl]-4-methoxy-pyran-2-one

C17H18O7 (334.1052)


   

3-O,8-O-Dimethylfusarubin

3-O,8-O-Dimethylfusarubin

C17H18O7 (334.1052)


   

Pterolinus D

Pterolinus D

C17H18O7 (334.1052)


An epoxide that is 7-oxabicyclo[4.1.0]hept-3-ene-2,5-dione substituted by a methoxy group at position 4 and a propan-2-yl group at position 1 which in turn is substituted by a hydroxy group and a 3-hydroxy-4-methoxyphenyl group at position 1. Isolated from Pterocarpus santalinus, it exhibits anti-inflammatory activity.

   

Daibucarboline B

Daibucarboline B

C19H14N2O4 (334.0954)


A natural product found in Neolitsea daibuensis.

   

Isobyakangelicin

Isobyakangelicin

C17H18O7 (334.1052)


   

(2S,5R,E)-7-hydroxy-4,6-dimethoxy-2-(1-methoxy-3-oxo-5-methylhex-1-enyl)-benzofuran-3(2H)-one

(2S,5R,E)-7-hydroxy-4,6-dimethoxy-2-(1-methoxy-3-oxo-5-methylhex-1-enyl)-benzofuran-3(2H)-one

C17H18O7 (334.1052)


   

(2S,1R)-5-hydroxy-2-(1-hydroxy-4-oxo-cyclohex-2-en-1-yl)-6,7-dimethoxy-2,3-dihydro-4H-chromen-4-one

(2S,1R)-5-hydroxy-2-(1-hydroxy-4-oxo-cyclohex-2-en-1-yl)-6,7-dimethoxy-2,3-dihydro-4H-chromen-4-one

C17H18O7 (334.1052)


   

ventiloquinone-K

ventiloquinone-K

C17H18O7 (334.1052)


   

3-[3-(alpha-hydroxy-isopropyl)-6-methoxy-2,3-dihydro-[1,4]dioxino[2,3-g]benzofuran-5-yl]-acrylic acid|3-[3-(alpha-Hydroxy-isopropyl)-6-methoxy-2,3-dihydro-[1,4]dioxino[2,3-g]benzofuran-5-yl]-acrylsaeure|Isobyakangelicolsaeure

3-[3-(alpha-hydroxy-isopropyl)-6-methoxy-2,3-dihydro-[1,4]dioxino[2,3-g]benzofuran-5-yl]-acrylic acid|3-[3-(alpha-Hydroxy-isopropyl)-6-methoxy-2,3-dihydro-[1,4]dioxino[2,3-g]benzofuran-5-yl]-acrylsaeure|Isobyakangelicolsaeure

C17H18O7 (334.1052)


   

(5S,6R,7R,8S)-2-[2-(4-hydroxyphenyl)ethyl]-5,6,7,8-tetrahydroxy-5,6,7,8-tetrahydrochromone|aquilarone F

(5S,6R,7R,8S)-2-[2-(4-hydroxyphenyl)ethyl]-5,6,7,8-tetrahydroxy-5,6,7,8-tetrahydrochromone|aquilarone F

C17H18O7 (334.1052)


   

perenniporide A

perenniporide A

C17H18O7 (334.1052)


   

(3S,4S)-4,6,1?2-tetrahydroxy-7,3-dimethoxyisoflavan|abruquinone J

(3S,4S)-4,6,1?2-tetrahydroxy-7,3-dimethoxyisoflavan|abruquinone J

C17H18O7 (334.1052)


   

Thamontanin

Thamontanin

C17H18O7 (334.1052)


   

9-isobutyryloxycalefolione

9-isobutyryloxycalefolione

C17H18O7 (334.1052)


   

7-methoxy-6-[1,4-dihydro-3-methyl-3-ethoxy-2-hydroxy-4-oxo-1-furanyl]coumarin|micromeloside D

7-methoxy-6-[1,4-dihydro-3-methyl-3-ethoxy-2-hydroxy-4-oxo-1-furanyl]coumarin|micromeloside D

C17H18O7 (334.1052)


   

Hydroxymetasequirin A

Hydroxymetasequirin A

C17H18O7 (334.1052)


   

Senaequidolide

Senaequidolide

C17H18O7 (334.1052)


   

(1-naphthyl)methanol glucuronide

(1-naphthyl)methanol glucuronide

C17H18O7 (334.1052)


   

2,4,6-Trihydroxy-3-methoxy-alpha-hydroxymethyl-beta-hydroxy-alpha,beta-dihydrochalcone

2,4,6-Trihydroxy-3-methoxy-alpha-hydroxymethyl-beta-hydroxy-alpha,beta-dihydrochalcone

C17H18O7 (334.1052)


   
   

Mukurozidiol

7H-Furo[3,2-g][1]benzopyran-7-one, 9-(2,3-dihydroxy-3-methylbutoxy)-4-methoxy-

C17H18O7 (334.1052)


Constituent of Japanese drug byakusi obtained from Angelica subspecies Also from lemon oil and other Citrus subspecies [DFC]. (R)-Byakangelicin is found in lemon, citrus, and herbs and spices. Mukurozidiol is a member of psoralens. (Rac)-Byakangelicin is a natural product found in Ruta graveolens, Angelica, and other organisms with data available. (S)-Byakangelicin is found in herbs and spices. (S)-Byakangelicin is a constituent of common rue (Ruta graveolens). D011838 - Radiation-Sensitizing Agents > D017319 - Photosensitizing Agents > D011564 - Furocoumarins (Rac)-Byakangelicin is a racemate of Byakangelicin mainly isolated from the genus Angelica. Byakangelicin is an aldose-reductase inhibitor with an IC50 value of 6.2 μM[1]. (Rac)-Byakangelicin is a racemate of Byakangelicin mainly isolated from the genus Angelica. Byakangelicin is an aldose-reductase inhibitor with an IC50 value of 6.2 μM[1]. Byakangelicin, one of the active compounds found in the roots of Angelica gigas, can serve as a modulator to improve brain accumulation of diverse active compounds (Umb, Cur, and Dox) and enhance therapeutic effects[1]. Byakangelicin is likely to increase the expression of all PXR target genes (such as MDR1) and induce a wide range of agent-agent interactions. Byakangelicin can inhibit the effects of sex hormones, it may increase the catabolism of endogenous hormones[2]. Byakangelicin, one of the active compounds found in the roots of Angelica gigas, can serve as a modulator to improve brain accumulation of diverse active compounds (Umb, Cur, and Dox) and enhance therapeutic effects[1]. Byakangelicin is likely to increase the expression of all PXR target genes (such as MDR1) and induce a wide range of agent-agent interactions. Byakangelicin can inhibit the effects of sex hormones, it may increase the catabolism of endogenous hormones[2].

   

9-(2,3-dihydroxy-3-methylbutoxy)-4-methoxyfuro[3,2-g]chromen-7-one

NCGC00385892-01!9-(2,3-dihydroxy-3-methylbutoxy)-4-methoxyfuro[3,2-g]chromen-7-one

C17H18O7 (334.1052)


   

Penicillin G

Penicillin-G

C16H18N2O4S (334.0987)


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 S - Sensory organs > S01 - Ophthalmologicals > S01A - Antiinfectives > S01AA - Antibiotics 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

   

Progabide

Progabide

C17H16ClFN2O2 (334.0884)


D002491 - Central Nervous System Agents > D018726 - Anti-Dyskinesia Agents > D000978 - Antiparkinson Agents D002491 - Central Nervous System Agents > D011619 - Psychotropic Drugs > D000928 - Antidepressive Agents N - Nervous system > N03 - Antiepileptics > N03A - Antiepileptics > N03AG - Fatty acid derivatives D018377 - Neurotransmitter Agents > D018682 - GABA Agents > D018755 - GABA Agonists C78272 - Agent Affecting Nervous System > C264 - Anticonvulsant Agent D002491 - Central Nervous System Agents > D000927 - Anticonvulsants Progabide is a gamma-aminobutyric acid receptor (GABA) agonist.

   

Benzylpenicillin

Benzylpenicillin

C16H18N2O4S (334.0987)


A penicillin in which the substituent at position 6 of the penam ring is a phenylacetamido group. Origin: Microbe; SubCategory_DNP: beta-Lactams, Penicillins

   

diflufenzopyr

diflufenzopyr

C15H12F2N4O3 (334.0877)


CONFIDENCE standard compound; INTERNAL_ID 1038; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4268; ORIGINAL_PRECURSOR_SCAN_NO 4265 CONFIDENCE standard compound; INTERNAL_ID 1038; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4282; ORIGINAL_PRECURSOR_SCAN_NO 4280 CONFIDENCE standard compound; INTERNAL_ID 1038; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4253; ORIGINAL_PRECURSOR_SCAN_NO 4249 CONFIDENCE standard compound; INTERNAL_ID 1038; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4267; ORIGINAL_PRECURSOR_SCAN_NO 4264 CONFIDENCE standard compound; INTERNAL_ID 1038; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4297; ORIGINAL_PRECURSOR_SCAN_NO 4294 CONFIDENCE standard compound; INTERNAL_ID 1038; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4294; ORIGINAL_PRECURSOR_SCAN_NO 4292 CONFIDENCE standard compound; INTERNAL_ID 1038; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8586; ORIGINAL_PRECURSOR_SCAN_NO 8584 CONFIDENCE standard compound; INTERNAL_ID 1038; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8595; ORIGINAL_PRECURSOR_SCAN_NO 8591 CONFIDENCE standard compound; INTERNAL_ID 1038; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8618; ORIGINAL_PRECURSOR_SCAN_NO 8614 CONFIDENCE standard compound; INTERNAL_ID 1038; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8648; ORIGINAL_PRECURSOR_SCAN_NO 8644 CONFIDENCE standard compound; INTERNAL_ID 1038; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8673; ORIGINAL_PRECURSOR_SCAN_NO 8670 CONFIDENCE standard compound; INTERNAL_ID 1038; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8633; ORIGINAL_PRECURSOR_SCAN_NO 8630

   

Penicillin G; LC-tDDA; CE10

Penicillin G; LC-tDDA; CE10

C16H18N2O4S (334.0987)


   

Penicillin G; LC-tDDA; CE20

Penicillin G; LC-tDDA; CE20

C16H18N2O4S (334.0987)


   

Penicillin G; LC-tDDA; CE30

Penicillin G; LC-tDDA; CE30

C16H18N2O4S (334.0987)


   

Penicillin G; LC-tDDA; CE40

Penicillin G; LC-tDDA; CE40

C16H18N2O4S (334.0987)


   

Penicillin G; AIF; CE0; CorrDec

Penicillin G; AIF; CE0; CorrDec

C16H18N2O4S (334.0987)


   

Penicillin G; AIF; CE10; CorrDec

Penicillin G; AIF; CE10; CorrDec

C16H18N2O4S (334.0987)


   

Penicillin G; AIF; CE30; CorrDec

Penicillin G; AIF; CE30; CorrDec

C16H18N2O4S (334.0987)


   

Penicillin G; AIF; CE0; MS2Dec

Penicillin G; AIF; CE0; MS2Dec

C16H18N2O4S (334.0987)


   

Penicillin G; AIF; CE10; MS2Dec

Penicillin G; AIF; CE10; MS2Dec

C16H18N2O4S (334.0987)


   

Penicillin G; AIF; CE30; MS2Dec

Penicillin G; AIF; CE30; MS2Dec

C16H18N2O4S (334.0987)


   

1-Naphthylmethanol glucuronide

1-Naphthylmethanol glucuronide

C17H18O7 (334.1052)


   

Oxychlorpromazine

Chlorpromazine sulphoxide

C17H19ClN2OS (334.0907)


   

7-Hydroxychlorpromazine

7-Hydroxychlorpromazine

C17H19ClN2OS (334.0907)


   

RG-108

-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)-(S)-1H-indole-3-propanoic acid

C19H14N2O4 (334.0954)


   

His-Gly-OH

2-(3-(2-(1H-imidazol-4-yl)ethoxy)-4-nitrobenzamido)acetic acid

C14H14N4O6 (334.0913)


   

Ala-His-OH

(S)-4-(1H-imidazol-4-yl)-2-(3-methoxy-4-nitrobenzamido)butanoic acid

C14H14N4O6 (334.0913)


   

(S)-a-Amino-2,5-dihydro-5-oxo-4-isoxazolepropanoic acid N2-glucoside

2-amino-3-{5-oxo-2-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-2,5-dihydro-1,2-oxazol-4-yl}propanoic acid

C12H18N2O9 (334.1012)


   
   

Triflubazam

Triflubazam

C17H13F3N2O2 (334.0929)


C78272 - Agent Affecting Nervous System > C29756 - Sedative and Hypnotic C78272 - Agent Affecting Nervous System > C28197 - Antianxiety Agent

   

Pyrimido[4,5-g]quinazoline-4,9-dione,3,8-dihydro-5,10-dihydroxy-2,7-bis(hydroxymethyl)-3,8-dimethyl-

Pyrimido[4,5-g]quinazoline-4,9-dione,3,8-dihydro-5,10-dihydroxy-2,7-bis(hydroxymethyl)-3,8-dimethyl-

C14H14N4O6 (334.0913)


   

N-(2-PHENOXYETHYL)-2-PROPANAMINE

N-(2-PHENOXYETHYL)-2-PROPANAMINE

C16H18N2O4S (334.0987)


   

8-anilinonaphthalene-1-sulfonic acid,azane,hydrate

8-anilinonaphthalene-1-sulfonic acid,azane,hydrate

C16H18N2O4S (334.0987)


   

Methyl 4-acetoxy-5,6,8-trimethoxy-2-naphthoate

Methyl 4-acetoxy-5,6,8-trimethoxy-2-naphthoate

C17H18O7 (334.1052)


   

Methyl 5-acetoxy-4,6,7-trimethoxy-2-naphthoate

Methyl 5-acetoxy-4,6,7-trimethoxy-2-naphthoate

C17H18O7 (334.1052)


   

Methyl 4-acetoxy-5,7,8-trimethoxy-2-naphthoate

Methyl 4-acetoxy-5,7,8-trimethoxy-2-naphthoate

C17H18O7 (334.1052)


   

4,4,5,5-TETRAMETHYL-2-(3-TRIFLUOROMETHYLSULFANYLMETHOXY-PHENYL)-[1,3,2]DIOXABOROLANE

4,4,5,5-TETRAMETHYL-2-(3-TRIFLUOROMETHYLSULFANYLMETHOXY-PHENYL)-[1,3,2]DIOXABOROLANE

C14H18BF3O3S (334.1022)


   

Triphenoxy(vinyl)silane

Triphenoxy(vinyl)silane

C20H18O3Si (334.1025)


   

Phenazine ethosulfate

5-Ethylphenazin-5-ium ethyl sulfate

C16H18N2O4S (334.0987)


   

2-tritylsulfanylacetic acid

2-tritylsulfanylacetic acid

C21H18O2S (334.1027)


   

3,3-(Hexafluoroisopropylidene)dianiline

3,3-(Hexafluoroisopropylidene)dianiline

C15H12F6N2 (334.0905)


   

1,5-DIPHENYL-3-(4-CHLOROPHENYL)FORMAZAN

1,5-DIPHENYL-3-(4-CHLOROPHENYL)FORMAZAN

C19H15ClN4 (334.0985)


   

2,2-Bis(4-aminophenyl)hexafluoropropane

2,2-Bis(4-aminophenyl)hexafluoropropane

C15H12F6N2 (334.0905)


   

ETHYL 2-(1-(((BENZYLOXY)CARBONYL)AMINO)ETHYL)THIAZOLE-5-CARBOXYLATE

ETHYL 2-(1-(((BENZYLOXY)CARBONYL)AMINO)ETHYL)THIAZOLE-5-CARBOXYLATE

C16H18N2O4S (334.0987)


   

[cyclohexylsulfonyl(diazo)methyl]sulfonylcyclohexane

[cyclohexylsulfonyl(diazo)methyl]sulfonylcyclohexane

C13H22N2O4S2 (334.1021)


   

2,3,4-Tri-O-acetyl-D-glucuronide methyl ester

2,3,4-Tri-O-acetyl-D-glucuronide methyl ester

C13H18O10 (334.09)


   

benzyl 2-(4-methylphenyl)sulfonyloxypropanoate

benzyl 2-(4-methylphenyl)sulfonyloxypropanoate

C17H18O5S (334.0875)


   

Febuxostat impurity 7

Febuxostat impurity 7

C16H18N2O4S (334.0987)


   

INDIUM(III) TERT-BUTOXIDE

INDIUM(III) TERT-BUTOXIDE

C12H27InO3 (334.0999)


   

Febuxostat amide impurity

Febuxostat amide impurity

C16H18N2O4S (334.0987)


   

1-Heptyl-4-(4-pyridyl)pyridinium bromide

1-Heptyl-4-(4-pyridyl)pyridinium bromide

C17H23BrN2 (334.1044)


   

4,4-diamino-2,2-di-(trifluoromethyl)-diphenylmethane

4,4-diamino-2,2-di-(trifluoromethyl)-diphenylmethane

C15H12F6N2 (334.0905)


   

4-(1-Allyl-7-(trifluoromethyl)-1H-indazol-3-yl)benzene-1,3-diol

4-(1-Allyl-7-(trifluoromethyl)-1H-indazol-3-yl)benzene-1,3-diol

C17H13F3N2O2 (334.0929)


   

Mefuparib hydrochloride

Mefuparib hydrochloride

C17H16ClFN2O2 (334.0884)


   

2,3,4-Tri-O-acetyl-alpha-D-glucuronic Acid Methyl Ester

2,3,4-Tri-O-acetyl-alpha-D-glucuronic Acid Methyl Ester

C13H18O10 (334.09)


   

2-[(3-Methoxyphenyl)-oxomethyl]imino-3,4-dimethyl-5-thiazolecarboxylic acid ethyl ester

2-[(3-Methoxyphenyl)-oxomethyl]imino-3,4-dimethyl-5-thiazolecarboxylic acid ethyl ester

C16H18N2O4S (334.0987)


   

8-Hydroxychlorpromazine

8-Hydroxychlorpromazine

C17H19ClN2OS (334.0907)


   

Phenothiazine, 2-chloro-10-(3-(dimethylamino)propyl)-3-hydroxy-

Phenothiazine, 2-chloro-10-(3-(dimethylamino)propyl)-3-hydroxy-

C17H19ClN2OS (334.0907)


   

N-Pyridoxyl-2-methylalanine-5-phosphate

N-Pyridoxyl-2-methylalanine-5-phosphate

C12H19N2O7P (334.093)


   

Byakangelicin

7H-Furo(3,2-g)(1)benzopyran-7-one, 9-(2,3-dihydroxy-3-methylbutoxy)-4-methoxy-, (R)-

C17H18O7 (334.1052)


Byakangelicin is a member of psoralens. Byakangelicin is a natural product found in Murraya koenigii, Triphasia trifolia, and other organisms with data available. D011838 - Radiation-Sensitizing Agents > D017319 - Photosensitizing Agents > D011564 - Furocoumarins (Rac)-Byakangelicin is a racemate of Byakangelicin mainly isolated from the genus Angelica. Byakangelicin is an aldose-reductase inhibitor with an IC50 value of 6.2 μM[1]. (Rac)-Byakangelicin is a racemate of Byakangelicin mainly isolated from the genus Angelica. Byakangelicin is an aldose-reductase inhibitor with an IC50 value of 6.2 μM[1]. Byakangelicin, one of the active compounds found in the roots of Angelica gigas, can serve as a modulator to improve brain accumulation of diverse active compounds (Umb, Cur, and Dox) and enhance therapeutic effects[1]. Byakangelicin is likely to increase the expression of all PXR target genes (such as MDR1) and induce a wide range of agent-agent interactions. Byakangelicin can inhibit the effects of sex hormones, it may increase the catabolism of endogenous hormones[2]. Byakangelicin, one of the active compounds found in the roots of Angelica gigas, can serve as a modulator to improve brain accumulation of diverse active compounds (Umb, Cur, and Dox) and enhance therapeutic effects[1]. Byakangelicin is likely to increase the expression of all PXR target genes (such as MDR1) and induce a wide range of agent-agent interactions. Byakangelicin can inhibit the effects of sex hormones, it may increase the catabolism of endogenous hormones[2].

   

(5R,6R)-3,3-dimethyl-7-oxo-6-[(2-phenylacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid

(5R,6R)-3,3-dimethyl-7-oxo-6-[(2-phenylacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid

C16H18N2O4S (334.0987)


   

2,3,5-Triphenyltetrazolium chloride

2,3,5-Triphenyltetrazolium chloride

C19H15ClN4 (334.0985)


D019995 - Laboratory Chemicals > D007202 - Indicators and Reagents > D013778 - Tetrazolium Salts D004396 - Coloring Agents

   

3-Epi-3-hydroxymugineate(2-)

3-Epi-3-hydroxymugineate(2-)

C12H18N2O9-2 (334.1012)


   

(4S,6S,7R,8S)-8-(carbamoyloxymethyl)-7-methoxy-12-methyl-10,11-dioxo-2,5-diazatetracyclo[7.4.0.02,7.04,6]trideca-1(9),12-dien-13-olate

(4S,6S,7R,8S)-8-(carbamoyloxymethyl)-7-methoxy-12-methyl-10,11-dioxo-2,5-diazatetracyclo[7.4.0.02,7.04,6]trideca-1(9),12-dien-13-olate

C15H16N3O6- (334.1039)


   

(4S,6S,7R,8R)-8-(carbamoyloxymethyl)-7-hydroxy-5,12-dimethyl-10,11-dioxo-2,5-diazatetracyclo[7.4.0.02,7.04,6]trideca-1(9),12-dien-13-olate

(4S,6S,7R,8R)-8-(carbamoyloxymethyl)-7-hydroxy-5,12-dimethyl-10,11-dioxo-2,5-diazatetracyclo[7.4.0.02,7.04,6]trideca-1(9),12-dien-13-olate

C15H16N3O6- (334.1039)


   

RG108

N-Phthalyl-L-Tryptophan

C19H14N2O4 (334.0954)


   
   

2-(2-ethylphenoxy)-N-(4-sulfamoylphenyl)acetamide

2-(2-ethylphenoxy)-N-(4-sulfamoylphenyl)acetamide

C16H18N2O4S (334.0987)


   

N-[(2-benzyl-5-oxo-1,3-oxazol-4(5H)-ylidene)methyl]-3-sulfanyl-D-valine

N-[(2-benzyl-5-oxo-1,3-oxazol-4(5H)-ylidene)methyl]-3-sulfanyl-D-valine

C16H18N2O4S (334.0987)


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

   

N-[3-[methyl(methylsulfonyl)amino]phenyl]-2-phenoxyacetamide

N-[3-[methyl(methylsulfonyl)amino]phenyl]-2-phenoxyacetamide

C16H18N2O4S (334.0987)


   

5-[(5-acetyl-2-propan-2-yloxyphenyl)methyl]-6-hydroxy-2-sulfanylidene-1H-pyrimidin-4-one

5-[(5-acetyl-2-propan-2-yloxyphenyl)methyl]-6-hydroxy-2-sulfanylidene-1H-pyrimidin-4-one

C16H18N2O4S (334.0987)


   

2-[3-Phenyl-7-(trifluoromethyl)-1-indazolyl]acetic acid methyl ester

2-[3-Phenyl-7-(trifluoromethyl)-1-indazolyl]acetic acid methyl ester

C17H13F3N2O2 (334.0929)


   

11beta,13-Dihydro-8-deoxylactucin 15-oxalate

11beta,13-Dihydro-8-deoxylactucin 15-oxalate

C17H18O7 (334.1052)


A sesquiterpene lactone obtained by formal condensation of one of the carboxy groups of oxalic acid with the 15-hydroxy group of 11beta,13-dihydro-8-deoxylactucin. Found in chicory.

   

4-(4-{[(4-Aminophenyl)sulfonyl]amino}phenyl)butanoic acid

4-(4-{[(4-Aminophenyl)sulfonyl]amino}phenyl)butanoic acid

C16H18N2O4S (334.0987)


   

3-(2-chloro-10-oxido-10-phenothiazin-10-iumyl)-N,N-dimethyl-1-propanamine

3-(2-chloro-10-oxido-10-phenothiazin-10-iumyl)-N,N-dimethyl-1-propanamine

C17H19ClN2OS (334.0907)


   

7-demethylmitomycin A(1-)

7-demethylmitomycin A(1-)

C15H16N3O6- (334.1039)


An organic anion obtained by removal of the acidic proton from position 8 of 7-demethylmitomycin A.

   

7-demethylmitomycin B(1-)

7-demethylmitomycin B(1-)

C15H16N3O6- (334.1039)


An organic anion obtained by removal of the acidic proton from position 8 of 7-demethylmitomycin B.

   

(2S,5S,6R)-3,3-dimethyl-7-oxo-6-[(1-oxo-2-phenylethyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid

(2S,5S,6R)-3,3-dimethyl-7-oxo-6-[(1-oxo-2-phenylethyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid

C16H18N2O4S (334.0987)


   

Chlorpromazine N-oxide

Chlorpromazine N-oxide

C17H19ClN2OS (334.0907)


An organochlorine compound that is chlorpromazine in which the acyclic tertiary amino group has been converted into the corresponding N-oxide.

   

Benzylpenicillenic acid

Benzylpenicillenic acid

C16H18N2O4S (334.0987)


A penicillenic acid having a benzyl substituent at the 2-position on the oxazolone ring.

   

BQU57

BQU57

C16H13F3N4O (334.1041)


BQU57 selectively inhibits Ral, with higher selectivity than Ras or Rho. The IC50 values of BQU57 on H2122 and H358 cells are 2.0 μM and 1.3 μM respectively.

   

(2r,3r,4ar)-2,7-dihydroxy-9-methoxy-4a-methyl-6-oxo-2h,3h,4h-benzo[c]chromen-3-yl acetate

(2r,3r,4ar)-2,7-dihydroxy-9-methoxy-4a-methyl-6-oxo-2h,3h,4h-benzo[c]chromen-3-yl acetate

C17H18O7 (334.1052)


   

6-ethyl-4',5-dihydroxy-2,7-dimethoxyspiro[naphthalene-1,2'-oxolane]-4,5'-dione

6-ethyl-4',5-dihydroxy-2,7-dimethoxyspiro[naphthalene-1,2'-oxolane]-4,5'-dione

C17H18O7 (334.1052)


   

(1r,3s)-7,10-dihydroxy-5,8-dimethoxy-1,3-dimethyl-1h,3h,4h-naphtho[2,3-c]pyran-6,9-dione

(1r,3s)-7,10-dihydroxy-5,8-dimethoxy-1,3-dimethyl-1h,3h,4h-naphtho[2,3-c]pyran-6,9-dione

C17H18O7 (334.1052)


   

3,7-dihydroxy-9-methoxy-4a-methyl-6-oxo-2h,3h,4h-benzo[c]chromen-2-yl acetate

3,7-dihydroxy-9-methoxy-4a-methyl-6-oxo-2h,3h,4h-benzo[c]chromen-2-yl acetate

C17H18O7 (334.1052)


   

4-[(2r)-2,3-dihydroxy-3-methylbutoxy]-9-methoxyfuro[3,2-g]chromen-7-one

4-[(2r)-2,3-dihydroxy-3-methylbutoxy]-9-methoxyfuro[3,2-g]chromen-7-one

C17H18O7 (334.1052)


   

(1s,2s,6r,8s,10s,12r)-8-methyl-3-methylidene-4,14-dioxo-5,9,15-trioxatetracyclo[11.2.1.0²,⁶.0⁸,¹⁰]hexadec-13(16)-en-12-yl acetate

(1s,2s,6r,8s,10s,12r)-8-methyl-3-methylidene-4,14-dioxo-5,9,15-trioxatetracyclo[11.2.1.0²,⁶.0⁸,¹⁰]hexadec-13(16)-en-12-yl acetate

C17H18O7 (334.1052)


   

(2r,3r,4s)-2-(3,4-dihydroxyphenyl)-4-ethoxy-3,4-dihydro-2h-1-benzopyran-3,7,8-triol

(2r,3r,4s)-2-(3,4-dihydroxyphenyl)-4-ethoxy-3,4-dihydro-2h-1-benzopyran-3,7,8-triol

C17H18O7 (334.1052)


   

6-[(2r)-2,3-dihydroxy-3-methylbutoxy]-5-methoxyfuro[2,3-h]chromen-2-one

6-[(2r)-2,3-dihydroxy-3-methylbutoxy]-5-methoxyfuro[2,3-h]chromen-2-one

C17H18O7 (334.1052)


   

3-ethoxy-5,10-dihydroxy-7-methoxy-3-methyl-1h,4h-naphtho[2,3-c]pyran-6,9-dione

3-ethoxy-5,10-dihydroxy-7-methoxy-3-methyl-1h,4h-naphtho[2,3-c]pyran-6,9-dione

C17H18O7 (334.1052)


   

9-hydroxy-8-methyl-3-methylidene-4,13-dioxo-5,14-dioxatricyclo[10.2.1.0²,⁶]pentadeca-7,12(15)-dien-11-yl acetate

9-hydroxy-8-methyl-3-methylidene-4,13-dioxo-5,14-dioxatricyclo[10.2.1.0²,⁶]pentadeca-7,12(15)-dien-11-yl acetate

C17H18O7 (334.1052)


   

4,5,7-trihydroxy-6-methoxy-3-(3-oxohexyl)naphthalene-1,2-dione

4,5,7-trihydroxy-6-methoxy-3-(3-oxohexyl)naphthalene-1,2-dione

C17H18O7 (334.1052)


   

6,9-dihydroxy-2-(2-hydroxypropyl)-8-methoxy-2h,3h,4h-naphtho[2,3-b]pyran-5,10-dione

6,9-dihydroxy-2-(2-hydroxypropyl)-8-methoxy-2h,3h,4h-naphtho[2,3-b]pyran-5,10-dione

C17H18O7 (334.1052)


   

5alpha,6beta,7beta,8alpha-tetrahydroxy-2-[2-(2'-hydroxy phenyl)ethyl]-5,6,7,8-tetrahydrochromone(ah23)

NA

C17H18O7 (334.1052)


{"Ingredient_id": "HBIN011381","Ingredient_name": "5alpha,6beta,7beta,8alpha-tetrahydroxy-2-[2-(2'-hydroxy phenyl)ethyl]-5,6,7,8-tetrahydrochromone(ah23)","Alias": "NA","Ingredient_formula": "C17H18O7","Ingredient_Smile": "C1=CC=C(C(=C1)CCC2=CC(=O)C3=C(O2)C(C(C(C3O)O)O)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "32033","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   

9-methoxy-4-(1,2,3-trihydroxy-3-methylbutyl)furo[3,2-g]chromen-7-one

9-methoxy-4-(1,2,3-trihydroxy-3-methylbutyl)furo[3,2-g]chromen-7-one

C17H18O7 (334.1052)


   

(2s,5r,6r)-6-[(1-hydroxy-2-phenylethylidene)amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid

(2s,5r,6r)-6-[(1-hydroxy-2-phenylethylidene)amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid

C16H18N2O4S (334.0987)


   

(1r,2r,6s,8s,10s,12s)-8-methyl-3-methylidene-4,14-dioxo-5,9,15-trioxatetracyclo[11.2.1.0²,⁶.0⁸,¹⁰]hexadec-13(16)-en-12-yl acetate

(1r,2r,6s,8s,10s,12s)-8-methyl-3-methylidene-4,14-dioxo-5,9,15-trioxatetracyclo[11.2.1.0²,⁶.0⁸,¹⁰]hexadec-13(16)-en-12-yl acetate

C17H18O7 (334.1052)


   

(1s,4s,6r,7r,13r,14s)-6,11-dimethyl-16-oxo-5,9,15,17-tetraoxapentacyclo[11.2.2.0¹,¹⁴.0⁴,⁶.0⁸,¹²]heptadeca-8(12),10-dien-7-yl acetate

(1s,4s,6r,7r,13r,14s)-6,11-dimethyl-16-oxo-5,9,15,17-tetraoxapentacyclo[11.2.2.0¹,¹⁴.0⁴,⁶.0⁸,¹²]heptadeca-8(12),10-dien-7-yl acetate

C17H18O7 (334.1052)


   

(2r)-5,10-dihydroxy-2-[(2s)-2-hydroxypropyl]-8-methoxy-2h,3h,4h-naphtho[2,3-b]pyran-6,9-dione

(2r)-5,10-dihydroxy-2-[(2s)-2-hydroxypropyl]-8-methoxy-2h,3h,4h-naphtho[2,3-b]pyran-6,9-dione

C17H18O7 (334.1052)


   

7-methyl-5,12-dimethylidene-7-(oxiran-2-yl)-4,11-dioxo-3,10-dioxatricyclo[7.3.0.0²,⁶]dodecan-8-yl acetate

7-methyl-5,12-dimethylidene-7-(oxiran-2-yl)-4,11-dioxo-3,10-dioxatricyclo[7.3.0.0²,⁶]dodecan-8-yl acetate

C17H18O7 (334.1052)


   

6,9-dihydroxy-7,8-dimethoxy-1,3-dimethyl-1h,3h,4h-naphtho[2,3-c]pyran-5,10-dione

6,9-dihydroxy-7,8-dimethoxy-1,3-dimethyl-1h,3h,4h-naphtho[2,3-c]pyran-5,10-dione

C17H18O7 (334.1052)


   

(3r)-6-hydroxy-3,7,9-trimethoxy-3-methyl-1h,4h-naphtho[2,3-c]pyran-5,10-dione

(3r)-6-hydroxy-3,7,9-trimethoxy-3-methyl-1h,4h-naphtho[2,3-c]pyran-5,10-dione

C17H18O7 (334.1052)


   

(1r,4r,6s,7r,13s,14r)-6,11-dimethyl-16-oxo-5,9,15,17-tetraoxapentacyclo[11.2.2.0¹,¹⁴.0⁴,⁶.0⁸,¹²]heptadeca-8(12),10-dien-7-yl acetate

(1r,4r,6s,7r,13s,14r)-6,11-dimethyl-16-oxo-5,9,15,17-tetraoxapentacyclo[11.2.2.0¹,¹⁴.0⁴,⁶.0⁸,¹²]heptadeca-8(12),10-dien-7-yl acetate

C17H18O7 (334.1052)


   

(1r,2r,3r,4s)-1,2,3,5-tetrahydroxy-7-methoxy-2,4-dimethyl-3,4-dihydro-1h-anthracene-9,10-dione

(1r,2r,3r,4s)-1,2,3,5-tetrahydroxy-7-methoxy-2,4-dimethyl-3,4-dihydro-1h-anthracene-9,10-dione

C17H18O7 (334.1052)


   

(1r,11s,12r)-12-hydroxy-1,3-dimethoxy-7,9,11-trimethyl-5,14,15-trioxatetracyclo[9.3.1.0²,¹⁰.0⁴,⁸]pentadeca-2(10),3,6,8-tetraen-13-one

(1r,11s,12r)-12-hydroxy-1,3-dimethoxy-7,9,11-trimethyl-5,14,15-trioxatetracyclo[9.3.1.0²,¹⁰.0⁴,⁸]pentadeca-2(10),3,6,8-tetraen-13-one

C17H18O7 (334.1052)


   

(2s,6r)-6-[(1-hydroxy-2-phenylethylidene)amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid

(2s,6r)-6-[(1-hydroxy-2-phenylethylidene)amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid

C16H18N2O4S (334.0987)


   

8-methyl-3-methylidene-4,14-dioxo-5,9,15-trioxatetracyclo[11.2.1.0²,⁶.0⁸,¹⁰]hexadec-13(16)-en-12-yl acetate

8-methyl-3-methylidene-4,14-dioxo-5,9,15-trioxatetracyclo[11.2.1.0²,⁶.0⁸,¹⁰]hexadec-13(16)-en-12-yl acetate

C17H18O7 (334.1052)


   

(2r,3r,4r)-2-(3,4-dihydroxyphenyl)-4-ethoxy-3,4-dihydro-2h-1-benzopyran-3,7,8-triol

(2r,3r,4r)-2-(3,4-dihydroxyphenyl)-4-ethoxy-3,4-dihydro-2h-1-benzopyran-3,7,8-triol

C17H18O7 (334.1052)


   

(3s)-5-hydroxy-8-(hydroxymethyl)-2,2-dimethyl-6-oxo-3h,4h-pyrano[3,2-g]chromen-3-yl acetate

(3s)-5-hydroxy-8-(hydroxymethyl)-2,2-dimethyl-6-oxo-3h,4h-pyrano[3,2-g]chromen-3-yl acetate

C17H18O7 (334.1052)


   

2,7-dihydroxy-9-methoxy-4a-methyl-6-oxo-2h,3h,4h-benzo[c]chromen-3-yl acetate

2,7-dihydroxy-9-methoxy-4a-methyl-6-oxo-2h,3h,4h-benzo[c]chromen-3-yl acetate

C17H18O7 (334.1052)


   

(1s,6r)-1-[(1s,2r)-1-hydroxy-1-(3-hydroxy-4-methoxyphenyl)propan-2-yl]-4-methoxy-7-oxabicyclo[4.1.0]hept-3-ene-2,5-dione

(1s,6r)-1-[(1s,2r)-1-hydroxy-1-(3-hydroxy-4-methoxyphenyl)propan-2-yl]-4-methoxy-7-oxabicyclo[4.1.0]hept-3-ene-2,5-dione

C17H18O7 (334.1052)


   

(3r)-3-hydroxy-6,7,9-trimethoxy-3-methyl-1h,4h-naphtho[2,3-c]pyran-5,10-dione

(3r)-3-hydroxy-6,7,9-trimethoxy-3-methyl-1h,4h-naphtho[2,3-c]pyran-5,10-dione

C17H18O7 (334.1052)


   

(1r,2r,6s,7e,11s)-8-(hydroxymethyl)-3-methylidene-4,13-dioxo-5,14-dioxatricyclo[10.2.1.0²,⁶]pentadeca-7,12(15)-dien-11-yl acetate

(1r,2r,6s,7e,11s)-8-(hydroxymethyl)-3-methylidene-4,13-dioxo-5,14-dioxatricyclo[10.2.1.0²,⁶]pentadeca-7,12(15)-dien-11-yl acetate

C17H18O7 (334.1052)


   

(2r,3r,4ar)-3,7-dihydroxy-9-methoxy-4a-methyl-6-oxo-2h,3h,4h-benzo[c]chromen-2-yl acetate

(2r,3r,4ar)-3,7-dihydroxy-9-methoxy-4a-methyl-6-oxo-2h,3h,4h-benzo[c]chromen-2-yl acetate

C17H18O7 (334.1052)


   

(1r,4'r)-6-ethyl-4',5-dihydroxy-2,7-dimethoxyspiro[naphthalene-1,2'-oxolane]-4,5'-dione

(1r,4'r)-6-ethyl-4',5-dihydroxy-2,7-dimethoxyspiro[naphthalene-1,2'-oxolane]-4,5'-dione

C17H18O7 (334.1052)


   

(2r)-6,9-dihydroxy-2-[(2s)-2-hydroxypropyl]-8-methoxy-2h,3h,4h-naphtho[2,3-b]pyran-5,10-dione

(2r)-6,9-dihydroxy-2-[(2s)-2-hydroxypropyl]-8-methoxy-2h,3h,4h-naphtho[2,3-b]pyran-5,10-dione

C17H18O7 (334.1052)


   

5,6-dihydroxy-3-[(2s)-2-hydroxy-3-methylbut-3-en-1-yl]-2,7-dimethoxynaphthalene-1,4-dione

5,6-dihydroxy-3-[(2s)-2-hydroxy-3-methylbut-3-en-1-yl]-2,7-dimethoxynaphthalene-1,4-dione

C17H18O7 (334.1052)


   

(2r,3s,4as)-3,7-dihydroxy-9-methoxy-4a-methyl-6-oxo-2h,3h,4h-benzo[c]chromen-2-yl acetate

(2r,3s,4as)-3,7-dihydroxy-9-methoxy-4a-methyl-6-oxo-2h,3h,4h-benzo[c]chromen-2-yl acetate

C17H18O7 (334.1052)


   

(1r,5r,6s)-5,6-bis(acetyloxy)-1-hydroxycyclohex-3-en-1-yl benzoate

(1r,5r,6s)-5,6-bis(acetyloxy)-1-hydroxycyclohex-3-en-1-yl benzoate

C17H18O7 (334.1052)


   

6-[(1-hydroxy-2-phenylethylidene)amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid

6-[(1-hydroxy-2-phenylethylidene)amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid

C16H18N2O4S (334.0987)


   

6-(4-ethoxy-3-hydroxy-4-methyl-5-oxooxolan-2-yl)-7-methoxychromen-2-one

6-(4-ethoxy-3-hydroxy-4-methyl-5-oxooxolan-2-yl)-7-methoxychromen-2-one

C17H18O7 (334.1052)


   

(1s,2r,6s,7r,8r,9s)-7-methyl-5,12-dimethylidene-7-[(2r)-oxiran-2-yl]-4,11-dioxo-3,10-dioxatricyclo[7.3.0.0²,⁶]dodecan-8-yl acetate

(1s,2r,6s,7r,8r,9s)-7-methyl-5,12-dimethylidene-7-[(2r)-oxiran-2-yl]-4,11-dioxo-3,10-dioxatricyclo[7.3.0.0²,⁶]dodecan-8-yl acetate

C17H18O7 (334.1052)


   

2,5,7-trihydroxy-6-methoxy-3-(3-oxohexyl)naphthalene-1,4-dione

2,5,7-trihydroxy-6-methoxy-3-(3-oxohexyl)naphthalene-1,4-dione

C17H18O7 (334.1052)


   

(2r,3r)-2-(3,5-dihydroxy-4-methoxyphenyl)-5-methoxy-3,4-dihydro-2h-1-benzopyran-3,7-diol

(2r,3r)-2-(3,5-dihydroxy-4-methoxyphenyl)-5-methoxy-3,4-dihydro-2h-1-benzopyran-3,7-diol

C17H18O7 (334.1052)


   

(2s,2'r,6's)-5-hydroxy-6'-(methoxycarbonyl)-3-oxospiro[1-benzofuran-2,1'-cycloheptane]-2'-carboxylic acid

(2s,2'r,6's)-5-hydroxy-6'-(methoxycarbonyl)-3-oxospiro[1-benzofuran-2,1'-cycloheptane]-2'-carboxylic acid

C17H18O7 (334.1052)


   

(5s,6s,7r)-5,6,9-trihydroxy-2,3-dimethoxy-7-methyl-5,6,7,8-tetrahydroanthracene-1,4-dione

(5s,6s,7r)-5,6,9-trihydroxy-2,3-dimethoxy-7-methyl-5,6,7,8-tetrahydroanthracene-1,4-dione

C17H18O7 (334.1052)


   

(2r,3s)-3-hydroxy-2-(hydroxymethyl)-3-phenyl-1-(2,4,6-trihydroxy-3-methoxyphenyl)propan-1-one

(2r,3s)-3-hydroxy-2-(hydroxymethyl)-3-phenyl-1-(2,4,6-trihydroxy-3-methoxyphenyl)propan-1-one

C17H18O7 (334.1052)


   

3-hydroxy-2-(hydroxymethyl)-3-phenyl-1-(2,4,6-trihydroxy-3-methoxyphenyl)propan-1-one

3-hydroxy-2-(hydroxymethyl)-3-phenyl-1-(2,4,6-trihydroxy-3-methoxyphenyl)propan-1-one

C17H18O7 (334.1052)


   

2-(3,4-dihydroxyphenyl)-4-ethoxy-3,4-dihydro-2h-1-benzopyran-3,7,8-triol

2-(3,4-dihydroxyphenyl)-4-ethoxy-3,4-dihydro-2h-1-benzopyran-3,7,8-triol

C17H18O7 (334.1052)


   

9-[(2s)-2,3-dihydroxy-3-methylbutoxy]-4-methoxyfuro[3,2-g]chromen-7-one

9-[(2s)-2,3-dihydroxy-3-methylbutoxy]-4-methoxyfuro[3,2-g]chromen-7-one

C17H18O7 (334.1052)


   

2-[(2,4-dihydroxy-3,5-dimethoxyphenyl)methyl]-5-methoxy-3-methylcyclohexa-2,5-diene-1,4-dione

2-[(2,4-dihydroxy-3,5-dimethoxyphenyl)methyl]-5-methoxy-3-methylcyclohexa-2,5-diene-1,4-dione

C17H18O7 (334.1052)


   

4-(2,3-dihydroxy-3-methylbutoxy)-9-methoxyfuro[3,2-g]chromen-7-one

4-(2,3-dihydroxy-3-methylbutoxy)-9-methoxyfuro[3,2-g]chromen-7-one

C17H18O7 (334.1052)


   

12-hydroxy-1,3-dimethoxy-7,9,11-trimethyl-5,14,15-trioxatetracyclo[9.3.1.0²,¹⁰.0⁴,⁸]pentadeca-2(10),3,6,8-tetraen-13-one

12-hydroxy-1,3-dimethoxy-7,9,11-trimethyl-5,14,15-trioxatetracyclo[9.3.1.0²,¹⁰.0⁴,⁸]pentadeca-2(10),3,6,8-tetraen-13-one

C17H18O7 (334.1052)


   

5,10-dihydroxy-2-(2-hydroxypropyl)-8-methoxy-2h,3h,4h-naphtho[2,3-b]pyran-6,9-dione

5,10-dihydroxy-2-(2-hydroxypropyl)-8-methoxy-2h,3h,4h-naphtho[2,3-b]pyran-6,9-dione

C17H18O7 (334.1052)


   

6-[(2r,3r,4r)-4-ethoxy-3-hydroxy-4-methyl-5-oxooxolan-2-yl]-7-methoxychromen-2-one

6-[(2r,3r,4r)-4-ethoxy-3-hydroxy-4-methyl-5-oxooxolan-2-yl]-7-methoxychromen-2-one

C17H18O7 (334.1052)


   

4-[(1e,3z)-2,4-diisocyanato-4-(4-methoxyphenyl)buta-1,3-dien-1-yl]phenol

4-[(1e,3z)-2,4-diisocyanato-4-(4-methoxyphenyl)buta-1,3-dien-1-yl]phenol

C19H14N2O4 (334.0954)


   

(2s,3s,4as)-3,7-dihydroxy-9-methoxy-4a-methyl-6-oxo-2h,3h,4h-benzo[c]chromen-2-yl acetate

(2s,3s,4as)-3,7-dihydroxy-9-methoxy-4a-methyl-6-oxo-2h,3h,4h-benzo[c]chromen-2-yl acetate

C17H18O7 (334.1052)


   

7,10-dihydroxy-5,8-dimethoxy-1,3-dimethyl-1h,3h,4h-naphtho[2,3-c]pyran-6,9-dione

7,10-dihydroxy-5,8-dimethoxy-1,3-dimethyl-1h,3h,4h-naphtho[2,3-c]pyran-6,9-dione

C17H18O7 (334.1052)


   

1,2,3,5-tetrahydroxy-7-methoxy-2,4-dimethyl-3,4-dihydro-1h-anthracene-9,10-dione

1,2,3,5-tetrahydroxy-7-methoxy-2,4-dimethyl-3,4-dihydro-1h-anthracene-9,10-dione

C17H18O7 (334.1052)


   

5-hydroxy-6'-(methoxycarbonyl)-3-oxospiro[1-benzofuran-2,1'-cycloheptane]-2'-carboxylic acid

5-hydroxy-6'-(methoxycarbonyl)-3-oxospiro[1-benzofuran-2,1'-cycloheptane]-2'-carboxylic acid

C17H18O7 (334.1052)


   

5,6-dihydroxy-3-(2-hydroxy-3-methylbut-3-en-1-yl)-2,7-dimethoxynaphthalene-1,4-dione

5,6-dihydroxy-3-(2-hydroxy-3-methylbut-3-en-1-yl)-2,7-dimethoxynaphthalene-1,4-dione

C17H18O7 (334.1052)


   

6,10-dihydroxy-5,7-dimethoxy-1,3-dimethyl-1h,3h,4h-naphtho[2,3-c]pyran-8,9-dione

6,10-dihydroxy-5,7-dimethoxy-1,3-dimethyl-1h,3h,4h-naphtho[2,3-c]pyran-8,9-dione

C17H18O7 (334.1052)


   

(1r,2r,6s,7z,9s,11s)-9-hydroxy-8-methyl-3-methylidene-4,13-dioxo-5,14-dioxatricyclo[10.2.1.0²,⁶]pentadeca-7,12(15)-dien-11-yl acetate

(1r,2r,6s,7z,9s,11s)-9-hydroxy-8-methyl-3-methylidene-4,13-dioxo-5,14-dioxatricyclo[10.2.1.0²,⁶]pentadeca-7,12(15)-dien-11-yl acetate

C17H18O7 (334.1052)


   

1,6,7-trihydroxy-2,3-dimethoxy-7-methyl-6,8-dihydro-5h-anthracene-9,10-dione

1,6,7-trihydroxy-2,3-dimethoxy-7-methyl-6,8-dihydro-5h-anthracene-9,10-dione

C17H18O7 (334.1052)


   

5,6,9-trihydroxy-2,3-dimethoxy-7-methyl-5,6,7,8-tetrahydroanthracene-1,4-dione

5,6,9-trihydroxy-2,3-dimethoxy-7-methyl-5,6,7,8-tetrahydroanthracene-1,4-dione

C17H18O7 (334.1052)


   

(7z)-8-(hydroxymethyl)-3-methylidene-4,13-dioxo-5,14-dioxatricyclo[10.2.1.0²,⁶]pentadeca-7,12(15)-dien-11-yl acetate

(7z)-8-(hydroxymethyl)-3-methylidene-4,13-dioxo-5,14-dioxatricyclo[10.2.1.0²,⁶]pentadeca-7,12(15)-dien-11-yl acetate

C17H18O7 (334.1052)


   
   

(1r,3s)-6,9-dihydroxy-7,8-dimethoxy-1,3-dimethyl-1h,3h,4h-naphtho[2,3-c]pyran-5,10-dione

(1r,3s)-6,9-dihydroxy-7,8-dimethoxy-1,3-dimethyl-1h,3h,4h-naphtho[2,3-c]pyran-5,10-dione

C17H18O7 (334.1052)


   

5,6-bis(acetyloxy)-1-hydroxycyclohex-3-en-1-yl benzoate

5,6-bis(acetyloxy)-1-hydroxycyclohex-3-en-1-yl benzoate

C17H18O7 (334.1052)


   

(6r,7s)-1,6,7-trihydroxy-2,3-dimethoxy-7-methyl-6,8-dihydro-5h-anthracene-9,10-dione

(6r,7s)-1,6,7-trihydroxy-2,3-dimethoxy-7-methyl-6,8-dihydro-5h-anthracene-9,10-dione

C17H18O7 (334.1052)


   

6-hydroxy-3,7,9-trimethoxy-3-methyl-1h,4h-naphtho[2,3-c]pyran-5,10-dione

6-hydroxy-3,7,9-trimethoxy-3-methyl-1h,4h-naphtho[2,3-c]pyran-5,10-dione

C17H18O7 (334.1052)


   

(2s,3s,4as)-2,7-dihydroxy-9-methoxy-4a-methyl-6-oxo-2h,3h,4h-benzo[c]chromen-3-yl acetate

(2s,3s,4as)-2,7-dihydroxy-9-methoxy-4a-methyl-6-oxo-2h,3h,4h-benzo[c]chromen-3-yl acetate

C17H18O7 (334.1052)


   

(1r,2r,6s,8s,10r,12s)-8-methyl-3-methylidene-4,14-dioxo-5,9,15-trioxatetracyclo[11.2.1.0²,⁶.0⁸,¹⁰]hexadec-13(16)-en-12-yl acetate

(1r,2r,6s,8s,10r,12s)-8-methyl-3-methylidene-4,14-dioxo-5,9,15-trioxatetracyclo[11.2.1.0²,⁶.0⁸,¹⁰]hexadec-13(16)-en-12-yl acetate

C17H18O7 (334.1052)


   

(1s,2s,6s,7s,8r,9s)-7-methyl-5,12-dimethylidene-7-[(2r)-oxiran-2-yl]-4,11-dioxo-3,10-dioxatricyclo[7.3.0.0²,⁶]dodecan-8-yl acetate

(1s,2s,6s,7s,8r,9s)-7-methyl-5,12-dimethylidene-7-[(2r)-oxiran-2-yl]-4,11-dioxo-3,10-dioxatricyclo[7.3.0.0²,⁶]dodecan-8-yl acetate

C17H18O7 (334.1052)


   

5,6-dihydroxy-3-[(2r)-2-hydroxy-3-methylbut-3-en-1-yl]-2,7-dimethoxynaphthalene-1,4-dione

5,6-dihydroxy-3-[(2r)-2-hydroxy-3-methylbut-3-en-1-yl]-2,7-dimethoxynaphthalene-1,4-dione

C17H18O7 (334.1052)


   

6-[2-(4,6-dimethoxy-2h-1,3-benzodioxol-5-yl)ethyl]-4-methoxypyran-2-one

6-[2-(4,6-dimethoxy-2h-1,3-benzodioxol-5-yl)ethyl]-4-methoxypyran-2-one

C17H18O7 (334.1052)