Exact Mass: 430.06103720000004

Exact Mass Matches: 430.06103720000004

Found 125 metabolites which its exact mass value is equals to given mass value 430.06103720000004, within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error 0.01 dalton.

Bicalutamide

4-Cyano-3-(4-fluorophenylsulfonyl)-2-hydroxy-2-methyl-3-(trifluoromethyl)propionanilide

C18H14F4N2O4S (430.06103720000004)


Bicalutamide is only found in individuals that have used or taken this drug. It is an oral non-steroidal anti-androgen for prostate cancer. It binds to the androgen receptor.Bicalutamide competes with androgen for the binding of androgen receptors, consequently blocking the action of androgens of adrenal and testicular origin which stimulate the growth of normal and malignant prostatic tissue. L - Antineoplastic and immunomodulating agents > L02 - Endocrine therapy > L02B - Hormone antagonists and related agents > L02BB - Anti-androgens D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006727 - Hormone Antagonists > D000726 - Androgen Antagonists C274 - Antineoplastic Agent > C163758 - Targeted Therapy Agent > C146993 - Androgen Receptor Inhibitor C147908 - Hormone Therapy Agent > C547 - Hormone Antagonist > C242 - Anti-Androgen COVID info from clinicaltrial, clinicaltrials, clinical trial, clinical trials D000970 - Antineoplastic Agents Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS

   

Benzofenap

2-{[4-(2,4-dichloro-3-methylbenzoyl)-1,3-dimethyl-1H-pyrazol-5-yl]oxy}-1-(4-methylphenyl)ethan-1-one

C22H20Cl2N2O3 (430.08509100000003)


Benzofenap is found in cereals and cereal products. Benzofenap is a herbicide used on rice. Herbicide used on rice. Benzofenap is found in cereals and cereal products.

   

CMP-2-aminoethylphosphonate

(2-aminoethyl)[({[(2R,3S,4R,5R)-3,4-dihydroxy-5-(2-hydroxy-4-imino-1,4-dihydropyrimidin-1-yl)oxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy]phosphinic acid

C11H20N4O10P2 (430.06546399999996)


This compound belongs to the family of Pyrimidine Ribonucleoside Diphosphates. These are pyrimidine ribobucleotides with diphosphate group linked to the ribose moiety.

   

Calcium gluconate

Calcium gluconate

C12H22CaO14 (430.06354220000003)


A - Alimentary tract and metabolism > A12 - Mineral supplements > A12A - Calcium > A12AA - Calcium C78275 - Agent Affecting Blood or Body Fluid > C29730 - Electrolyte Replacement Agent D - Dermatologicals

   

Chrysin-7-O-glucoronide

Chrysin-7-O-glucoronide

C21H18O10 (430.0899928)


   

Coumestrin

14-hydroxy-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-8,17-dioxatetracyclo[8.7.0.0²,⁷.0¹¹,¹⁶]heptadeca-1(10),2(7),3,5,11(16),12,14-heptaen-9-one

C21H18O10 (430.0899928)


Constituent of Glycine max (soybean). Coumestrin is found in alfalfa, soy bean, and pulses. Coumestrin is found in alfalfa. Coumestrin is a constituent of Glycine max (soybean).

   

Daidzein 7-O-glucuronide

(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-{[3-(4-hydroxyphenyl)-4-oxo-4H-chromen-7-yl]oxy}oxane-2-carboxylic acid

C21H18O10 (430.0899928)


Daidzein 7-O-glucuronide is a polyphenol metabolite detected in biological fluids (PMID: 20428313).

   

3,4,5-trihydroxy-6-[(7-hydroxy-4-oxo-2-phenyl-4H-chromen-5-yl)oxy]oxane-2-carboxylic acid

3,4,5-trihydroxy-6-[(7-hydroxy-4-oxo-2-phenyl-4H-chromen-5-yl)oxy]oxane-2-carboxylic acid

C21H18O10 (430.0899928)


   

2-[2-(3,4-Dihydroxyphenyl)-5,7-dihydroxy-4-oxo-4H-1-benzopyran-6-yl]-3,4-dihydroxy-6-methyl-3,4-dihydro-2H-pyran-5(6H)-one

2-[2-(3,4-Dihydroxyphenyl)-5,7-dihydroxy-4-oxo-4H-1-benzopyran-6-yl]-3,4-dihydroxy-6-methyl-3,4-dihydro-2H-pyran-5(6H)-one

C21H18O10 (430.0899928)


   

Daidzein 4'-O-glucuronide

(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[4-(7-hydroxy-4-oxo-4H-chromen-3-yl)phenoxy]oxane-2-carboxylic acid

C21H18O10 (430.0899928)


Daidzein 4-O-glucuronide is a polyphenol metabolite detected in biological fluids (PMID: 20428313).

   

Acetamide, N-(4-((6-(4-(trifluoromethyl)phenyl)-4-pyrimidinyl)oxy)-2-benzothiazolyl)-

N-[4-({6-[4-(trifluoromethyl)phenyl]pyrimidin-4-yl}oxy)-1,3-benzothiazol-2-yl]acetamide

C20H13F3N4O2S (430.0711274)


   

Formononetin-B-D-glucuronide sodium salt

3,4,5-trihydroxy-6-{[3-(4-hydroxyphenyl)-4-oxo-4H-chromen-7-yl]oxy}oxane-2-carboxylic acid

C21H18O10 (430.0899928)


   

Derhamnosylmaysin

6-[(2R,3S,4S,6S)-3,4-dihydroxy-6-methyl-5-oxooxan-2-yl]-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4H-chromen-4-one

C21H18O10 (430.0899928)


Derhamnosylmaysin is a member of the class of compounds known as flavonoid c-glycosides. Flavonoid c-glycosides are compounds containing a carbohydrate moiety which is C-glycosidically linked to the 2-phenylchromen-4-one flavonoid backbone. Derhamnosylmaysin is slightly soluble (in water) and a very weakly acidic compound (based on its pKa). Derhamnosylmaysin can be found in corn, which makes derhamnosylmaysin a potential biomarker for the consumption of this food product.

   

Calcium gluconate

Calcium bis(2,3,4,5,6-pentahydroxyhexanoic acid)

C12H22CaO14 (430.06354220000003)


Food additive: firming agent, sequestrant, stabiliser, texturiser. Anticaking agent in powdered coffee↵↵Calcium gluconate is a mineral supplement. It is the form of calcium most widely used in the treatment of hypocalcemia. Calcium gluconate contains 9.3\\% calcium. It is also used to counteract an overdose of magnesium sulfate, often administered to pregnant women experiencing premature labor to slow or stop contractions. Excess magnesium sulfate can cause respiratory depression, for which calcium gluconate would be the antidote. Food additive: firming agent, sequestrant, stabiliser, texturiser. Anticaking agent in powdered coffee

   

Chrysin 7-glucuronide

(2S,3S,4S,5R,6S)-3,4,5-Trihydroxy-6-((5-hydroxy-4-oxo-2-phenyl-4H-chromen-7-yl)oxy)tetrahydro-2H-pyran-2-carboxylic acid

C21H18O10 (430.0899928)


Chrysin-7-O-glucuronide is a member of flavonoids and a glucosiduronic acid. Chrysin-7-O-glucuronide is a natural product found in Scutellaria indica, Scutellaria immaculata, and other organisms with data available. Chrysin-7-O-glucuronide is a flavonoid extracted from Scutellaria baicalensis, with antioxidant activity[1]. Chrysin-7-O-glucuronide is a flavonoid extracted from Scutellaria baicalensis, with antioxidant activity[1].

   

7,4-Dihydroxyflavone 7-O-beta-D-glucuronoside

7,4-Dihydroxyflavone 7-O-beta-D-glucuronoside

C21H18O10 (430.0899928)


   

6-(8-Umbelliferyl)apigenin

8-[5,7-Dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-1-benzopyran-6-yl]-7-hydroxy-2H-1-benzopyran-2-one

C24H14O8 (430.0688644)


   

8-(6-Umbelliferyl)apigenin

6-[5,7-Dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-1-benzopyran-8-yl]-7-hydroxy-2H-1-benzopyran-2-one

C24H14O8 (430.0688644)


   

3,5,8,3-Tetramethoxy-6,7:4,5-bis(methylenedioxy)flavone

3,5,8,3-Tetramethoxy-6,7:4,5-bis (methylenedioxy) flavone

C21H18O10 (430.0899928)


   

Coumestrin

14-hydroxy-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-8,17-dioxatetracyclo[8.7.0.0^{2,7}.0^{11,16}]heptadeca-1(10),2,4,6,11,13,15-heptaen-9-one

C21H18O10 (430.0899928)


   

Derhamnosylmaysin

5,7,3,4-Tetrahydroxy-6-C- (6-deoxy-xylo-hexose-4-urosyl) flavone

C21H18O10 (430.0899928)


   

2-((2-(4-Bromophenyl)-2-oxoethyl)sulfanyl)-3-isobutyl-4(3H)-quinazolinone

2-((2-(4-Bromophenyl)-2-oxoethyl)sulfanyl)-3-isobutyl-4(3H)-quinazolinone

C20H19BrN2O2S (430.03505340000004)


   
   
   
   

(+)-epigallocatechin-4-phloroglucinol

(+)-epigallocatechin-4-phloroglucinol

C21H18O10 (430.0899928)


   

9-Acetoxymethyl-4,6-diformyl-3,8-dihydroxy-1-methyl-11-oxo-11H-dibenzo[b,e][1,4]dioxepin-7-carbonsaeure|9-acetoxymethyl-4,6-diformyl-3,8-dihydroxy-1-methyl-11-oxo-11H-dibenzo[b,e][1,4]dioxepin-7-carboxylic acid

9-Acetoxymethyl-4,6-diformyl-3,8-dihydroxy-1-methyl-11-oxo-11H-dibenzo[b,e][1,4]dioxepin-7-carbonsaeure|9-acetoxymethyl-4,6-diformyl-3,8-dihydroxy-1-methyl-11-oxo-11H-dibenzo[b,e][1,4]dioxepin-7-carboxylic acid

C20H14O11 (430.0536094)


   

6-(8-Umbelliferyl)-apigenin

6-(8-Umbelliferyl)-apigenin

C24H14O8 (430.0688644)


   
   
   
   

5-{4-[4-(5-pent-1,3-diynylthiophen-2-yl)-but-3-ynyloxy]-but-1-ynyl}-2,2-bithiophene|echinoetherthiophene

5-{4-[4-(5-pent-1,3-diynylthiophen-2-yl)-but-3-ynyloxy]-but-1-ynyl}-2,2-bithiophene|echinoetherthiophene

C25H18OS3 (430.0519738)


   

14-hydroxy-8beta-(3-chloro-2-hydroxyisobutyryloxy)-3-chlorodehydroleucodin|14-hydroxy-8beta-<3-chloro-2-hydroxyisobutyryloxy>-3-chlorodehydroleucodin

14-hydroxy-8beta-(3-chloro-2-hydroxyisobutyryloxy)-3-chlorodehydroleucodin|14-hydroxy-8beta-<3-chloro-2-hydroxyisobutyryloxy>-3-chlorodehydroleucodin

C19H20Cl2O7 (430.058603)


   
   

diphosphoric acid-1-(2-amino-ethyl ester)-2-(2-deoxy-cytidin-5-yl ester)|Diphosphorsaeure-1-(2-amino-aethylester)-2-(2-desoxy-cytidin-5-ylester)

diphosphoric acid-1-(2-amino-ethyl ester)-2-(2-deoxy-cytidin-5-yl ester)|Diphosphorsaeure-1-(2-amino-aethylester)-2-(2-desoxy-cytidin-5-ylester)

C11H20N4O10P2 (430.06546399999996)


   
   

chrysin 7-glucuronide|chrysin 7-O-beta-glucuronide

chrysin 7-glucuronide|chrysin 7-O-beta-glucuronide

C21H18O10 (430.0899928)


   

alpha-Acetylhypoconstictic acid

alpha-Acetylhypoconstictic acid

C21H18O10 (430.0899928)


   

Chrysin-7-O-glucuronide

(2S,3S,4S,5R,6S)-3,4,5-Trihydroxy-6-((5-hydroxy-4-oxo-2-phenyl-4H-chromen-7-yl)oxy)tetrahydro-2H-pyran-2-carboxylic acid

C21H18O10 (430.0899928)


Chrysin-7-O-glucuronide is a member of flavonoids and a glucosiduronic acid. Chrysin-7-O-glucuronide is a natural product found in Scutellaria indica, Scutellaria immaculata, and other organisms with data available. Chrysin-7-O-glucuronide is a flavonoid extracted from Scutellaria baicalensis, with antioxidant activity[1]. Chrysin-7-O-glucuronide is a flavonoid extracted from Scutellaria baicalensis, with antioxidant activity[1].

   

Bicalutamide

(2R)-N-[4-cyano-3-(trifluoromethyl)phenyl]-3-[(4-fluorophenyl)sulfonyl]-2-hydroxy-2-methylpropanamide

C18H14F4N2O4S (430.06103720000004)


L - Antineoplastic and immunomodulating agents > L02 - Endocrine therapy > L02B - Hormone antagonists and related agents > L02BB - Anti-androgens D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006727 - Hormone Antagonists > D000726 - Androgen Antagonists C274 - Antineoplastic Agent > C163758 - Targeted Therapy Agent > C146993 - Androgen Receptor Inhibitor C147908 - Hormone Therapy Agent > C547 - Hormone Antagonist > C242 - Anti-Androgen COVID info from clinicaltrial, clinicaltrials, clinical trial, clinical trials D000970 - Antineoplastic Agents Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS CONFIDENCE standard compound; INTERNAL_ID 519; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4405; ORIGINAL_PRECURSOR_SCAN_NO 4401 CONFIDENCE standard compound; INTERNAL_ID 519; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4432; ORIGINAL_PRECURSOR_SCAN_NO 4429 CONFIDENCE standard compound; INTERNAL_ID 519; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4382; ORIGINAL_PRECURSOR_SCAN_NO 4377 CONFIDENCE standard compound; INTERNAL_ID 519; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4426; ORIGINAL_PRECURSOR_SCAN_NO 4422 CONFIDENCE standard compound; INTERNAL_ID 519; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4399; ORIGINAL_PRECURSOR_SCAN_NO 4398 CONFIDENCE standard compound; INTERNAL_ID 519; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4400; ORIGINAL_PRECURSOR_SCAN_NO 4397 CONFIDENCE standard compound; INTERNAL_ID 2349 CONFIDENCE standard compound; INTERNAL_ID 8615 CONFIDENCE standard compound; EAWAG_UCHEM_ID 2809

   

(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-(5-hydroxy-4-oxo-2-phenylchromen-7-yl)oxyoxane-2-carboxylic acid

NCGC00385353-01!(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-(5-hydroxy-4-oxo-2-phenylchromen-7-yl)oxyoxane-2-carboxylic acid

C21H18O10 (430.0899928)


   

methyl 3,5-dichloro-2-hydroxy-6-(4-hydroxy-2-methoxy-6-methoxycarbonylphenoxy)-4-methylbenzoate

NCGC00347615-02!methyl 3,5-dichloro-2-hydroxy-6-(4-hydroxy-2-methoxy-6-methoxycarbonylphenoxy)-4-methylbenzoate

C18H16Cl2O8 (430.02221959999997)


   

(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-(5-hydroxy-4-oxo-2-phenylchromen-7-yl)oxyoxane-2-carboxylic acid

(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-(5-hydroxy-4-oxo-2-phenylchromen-7-yl)oxyoxane-2-carboxylic acid

C21H18O10 (430.0899928)


   

Coumestan base + 2O, O-Hex

Coumestan base + 2O, O-Hex

C21H18O10 (430.0899928)


Annotation level-3

   

methyl 3,5-dichloro-2-hydroxy-6-(4-hydroxy-2-methoxy-6-methoxycarbonylphenoxy)-4-methylbenzoate [IIN-based: Match]

NCGC00347615-02!methyl 3,5-dichloro-2-hydroxy-6-(4-hydroxy-2-methoxy-6-methoxycarbonylphenoxy)-4-methylbenzoate [IIN-based: Match]

C18H16Cl2O8 (430.02221959999997)


   

methyl 3,5-dichloro-2-hydroxy-6-(4-hydroxy-2-methoxy-6-methoxycarbonylphenoxy)-4-methylbenzoate [IIN-based on: CCMSLIB00000847501]

NCGC00347615-02!methyl 3,5-dichloro-2-hydroxy-6-(4-hydroxy-2-methoxy-6-methoxycarbonylphenoxy)-4-methylbenzoate [IIN-based on: CCMSLIB00000847501]

C18H16Cl2O8 (430.02221959999997)


   

MK-274

MK-274

C18H12F6N4O2 (430.08644039999996)


CONFIDENCE standard compound; INTERNAL_ID 342; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4920; ORIGINAL_PRECURSOR_SCAN_NO 4919 CONFIDENCE standard compound; INTERNAL_ID 342; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4855; ORIGINAL_PRECURSOR_SCAN_NO 4854 CONFIDENCE standard compound; INTERNAL_ID 342; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4943; ORIGINAL_PRECURSOR_SCAN_NO 4942 CONFIDENCE standard compound; INTERNAL_ID 342; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4866; ORIGINAL_PRECURSOR_SCAN_NO 4864 CONFIDENCE standard compound; INTERNAL_ID 342; DATASET 20200303_ENTACT_RP_MIX499; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4444; ORIGINAL_PRECURSOR_SCAN_NO 4442 CONFIDENCE standard compound; INTERNAL_ID 342; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4865; ORIGINAL_PRECURSOR_SCAN_NO 4862 CONFIDENCE standard compound; INTERNAL_ID 342; DATASET 20200303_ENTACT_RP_MIX499; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9221; ORIGINAL_PRECURSOR_SCAN_NO 9219 CONFIDENCE standard compound; INTERNAL_ID 342; DATASET 20200303_ENTACT_RP_MIX503; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9252; ORIGINAL_PRECURSOR_SCAN_NO 9249 ORIGINAL_PRECURSOR_SCAN_NO 9265; CONFIDENCE standard compound; INTERNAL_ID 342; DATASET 20200303_ENTACT_RP_MIX499; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9267 CONFIDENCE standard compound; INTERNAL_ID 342; DATASET 20200303_ENTACT_RP_MIX499; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9267; ORIGINAL_PRECURSOR_SCAN_NO 9265 DATA_PROCESSING MERGING RMBmix ver. 0.2.7; CONFIDENCE standard compound; INTERNAL_ID 342; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9354; ORIGINAL_PRECURSOR_SCAN_NO 9352 CONFIDENCE standard compound; INTERNAL_ID 342; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9354; ORIGINAL_PRECURSOR_SCAN_NO 9352 CONFIDENCE standard compound; INTERNAL_ID 342; DATASET 20200303_ENTACT_RP_MIX499; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9301; ORIGINAL_PRECURSOR_SCAN_NO 9299 CONFIDENCE standard compound; INTERNAL_ID 342; DATASET 20200303_ENTACT_RP_MIX499; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9176; ORIGINAL_PRECURSOR_SCAN_NO 9173

   

Cys Cys Cys Cys

(2R)-2-[(2R)-2-[(2R)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-sulfanylpropanamido]-3-sulfanylpropanamido]-3-sulfanylpropanoic acid

C12H22N4O5S4 (430.0473002)


   

Daidzein 4'-O-glucuronide

(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[4-(7-hydroxy-4-oxo-4H-chromen-3-yl)phenoxy]oxane-2-carboxylic acid

C21H18O10 (430.0899928)


   

Daidzein 7-O-glucuronide

(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-{[3-(4-hydroxyphenyl)-4-oxo-4H-chromen-7-yl]oxy}oxane-2-carboxylic acid

C21H18O10 (430.0899928)


   
   

SNS-314

SNS-314

C18H15ClN6OS2 (430.043725)


C274 - Antineoplastic Agent > C2189 - Signal Transduction Inhibitor > C129824 - Antineoplastic Protein Inhibitor C471 - Enzyme Inhibitor > C1404 - Protein Kinase Inhibitor > C61074 - Serine/Threonine Kinase Inhibitor C471 - Enzyme Inhibitor > C129825 - Antineoplastic Enzyme Inhibitor

   

2-Methyl-2-propanyl 4-hydroxy-8-iodo-5,7-dimethoxy-2-naphthoate

2-Methyl-2-propanyl 4-hydroxy-8-iodo-5,7-dimethoxy-2-naphthoate

C17H19IO5 (430.0277194)


   

2-pentylcyclopenta-1,3-diene,zirconium(4+),dichloride

2-pentylcyclopenta-1,3-diene,zirconium(4+),dichloride

C20H30Cl2Zr (430.07715199999996)


   

bis-(1-Butyl-3-methylcyclopentadienyl)zirconium dichloride

bis-(1-Butyl-3-methylcyclopentadienyl)zirconium dichloride

C20H30Cl2Zr (430.07715199999996)


   

Diphenyl(4-fluorophenyl)sulphoniumtrifluoromethanesulphonate

Diphenyl(4-fluorophenyl)sulphoniumtrifluoromethanesulphonate

C19H14F4O3S2 (430.0320462)


   

BORON SUBPHTHALOCYANINE CHLORIDE

BORON SUBPHTHALOCYANINE CHLORIDE

C24H12BClN6 (430.0904972)


   

bis(2,3-dichloropropyl) octyl phosphate

bis(2,3-dichloropropyl) octyl phosphate

C14H27Cl4O4P (430.04009920000004)


   
   

Bis(pentamethylcyclopentadienyl)zirconium dichloride

Bis(pentamethylcyclopentadienyl)zirconium dichloride

C20H30Cl2Zr (430.07715199999996)


   

N-[4-Cyano-3-(trifluoromethyl)phenyl]-3-[(2-fluorophenyl)sulfonyl]-2-hydroxy-2-methylpropanamide

N-[4-Cyano-3-(trifluoromethyl)phenyl]-3-[(2-fluorophenyl)sulfonyl]-2-hydroxy-2-methylpropanamide

C18H14F4N2O4S (430.06103720000004)


   

pentavinylpentamethylcyclopentasiloxane

pentavinylpentamethylcyclopentasiloxane

C15H30O5Si5 (430.093953)


   

1,2,3,4-Butanetetrol,1,4-bis(4-methylbenzenesulfonate), (2R,3R)-

1,2,3,4-Butanetetrol,1,4-bis(4-methylbenzenesulfonate), (2R,3R)-

C18H22O8S2 (430.0756052)


   

1-BENZYL-4-(2-BROMO-BENZENESULFONYL)-PIPERAZINE HYDROCHLORIDE

1-BENZYL-4-(2-BROMO-BENZENESULFONYL)-PIPERAZINE HYDROCHLORIDE

C17H20BrClN2O2S (430.01173100000005)


   

Ethylendiamintetraacetic acid,di-sodium-magnesium salt

Ethylendiamintetraacetic acid,di-sodium-magnesium salt

C10H20MgN2Na2O12 (430.06621)


   

SulfaMide, N-[5-(4-broMophenyl)-6-(2-hydroxyethoxy)-4-pyriMidinyl]-N-propyl-

SulfaMide, N-[5-(4-broMophenyl)-6-(2-hydroxyethoxy)-4-pyriMidinyl]-N-propyl-

C15H19BrN4O4S (430.0310314)


   
   

bis(trifluoromethylsulfonyl)azanide,1-butyl-3-methylpyridin-1-ium

bis(trifluoromethylsulfonyl)azanide,1-butyl-3-methylpyridin-1-ium

C12H16F6N2O4S2 (430.0455648)


   

Thiazolidine, 2-(4-methoxy-3-nitrophenyl)-3-(1-naphthalenylsulfonyl)- (9CI)

Thiazolidine, 2-(4-methoxy-3-nitrophenyl)-3-(1-naphthalenylsulfonyl)- (9CI)

C20H18N2O5S2 (430.0657098)


   

Dinsed

Benzenesulfonamide,N,N-1,2-ethanediylbis[3-nitro-

C14H14N4O8S2 (430.0253044)


C254 - Anti-Infective Agent > C276 - Antiparasitic Agent > C277 - Antiprotozoal Agent

   
   

1-octyl-3-methylimidazolium hexafluoroantimonate

1-octyl-3-methylimidazolium hexafluoroantimonate

C12H23F6N2Sb (430.080357)


   

3-(4-chloro-anilino)-10-(4-chloro-phenyl)-10H-phenazin-2-ylideneamine

3-(4-chloro-anilino)-10-(4-chloro-phenyl)-10H-phenazin-2-ylideneamine

C24H16Cl2N4 (430.0751956)


   

ARS-1630

(S)-1-(4-(6-chloro-8-fluoro-7-(2-fluoro-6-hydroxyphenyl)quinazolin-4-yl)piperazin-1-yl)prop-2-en-1-one

C21H17ClF2N4O2 (430.10080359999995)


ARS-1323, the racemate of ARS-1620, is a novel inhibitor of mutant K-ras G12C extracted from patent WO 2015054572 A1. ARS-1620 is an atropisomeric selective KRASG12C inhibitor with desirable pharmacokinetics. ARS-1630, a less active enantiomer of ARS-1620, is a novel inhibitor of mutant K-ras G12C extracted from patent WO 2015054572 A1.

   

Dantrolene Related Compound A (50 mg) (5-(4-nitrophenyl)-2-furaldehyde azine)

Dantrolene Related Compound A (50 mg) (5-(4-nitrophenyl)-2-furaldehyde azine)

C22H14N4O6 (430.0913304)


   

1,2,3,4-Butanetetrol,1,4-bis(4-methylbenzenesulfonate), (2S,3S)-

1,2,3,4-Butanetetrol,1,4-bis(4-methylbenzenesulfonate), (2S,3S)-

C18H22O8S2 (430.0756052)


   

1-(3-Cyanopropyl)-3-methylimidazolium bis(trifluoromethylsulfonyl)amide

1-(3-Cyanopropyl)-3-methylimidazolium bis(trifluoromethylsulfonyl)amide

C10H12F6N4O4S2 (430.0204144)


   

1-(4,5-DIMETHYL-2-THIAZOLYL)-PIPERAZINE

1-(4,5-DIMETHYL-2-THIAZOLYL)-PIPERAZINE

C18H18ClF3N4O3 (430.1019464)


   

sodium 1-amino-9,10-dihydro-9,10-dioxo-4-o-toluidinoanthracene-2-sulphonate

sodium 1-amino-9,10-dihydro-9,10-dioxo-4-o-toluidinoanthracene-2-sulphonate

C21H15N2NaO5S (430.05993400000006)


   

Daidzein-7-o-glucuronide

Daidzein-7-o-glucuronide

C21H18O10 (430.0899928)


   

N-(5-(1-(2,6-dichlorophenyl)-3-(difluoromethyl)-1H-pyrazol-5-yl)thiazol-2-yl)isobutyramide

N-(5-(1-(2,6-dichlorophenyl)-3-(difluoromethyl)-1H-pyrazol-5-yl)thiazol-2-yl)isobutyramide

C17H14Cl2F2N4OS (430.02333980000003)


D004791 - Enzyme Inhibitors > D047428 - Protein Kinase Inhibitors

   

4-[(5-Naphthalen-1-yl-1,3,4-oxadiazol-2-yl)sulfanyl]but-2-ynyl 4-methoxybenzoate

4-[(5-Naphthalen-1-yl-1,3,4-oxadiazol-2-yl)sulfanyl]but-2-ynyl 4-methoxybenzoate

C24H18N2O4S (430.0987228)


   

5-[(2,4-Dinitrophenyl)amino]-2-anilinobenzenesulphonic acid

5-[(2,4-Dinitrophenyl)amino]-2-anilinobenzenesulphonic acid

C18H14N4O7S (430.0583174)


   

N-[5-(1H-benzimidazol-2-ylmethylidene)-4-oxo-2-sulfanylidene-3-thiazolidinyl]-4-methylbenzenesulfonamide

N-[5-(1H-benzimidazol-2-ylmethylidene)-4-oxo-2-sulfanylidene-3-thiazolidinyl]-4-methylbenzenesulfonamide

C18H14N4O3S3 (430.0228014)


   

3-[5-fluoro-2-(2,2,3,3,3-pentafluoropropoxy)biphenyl-3-yl]-1H-1,2,4-triazole-5-carboxamide

3-[5-fluoro-2-(2,2,3,3,3-pentafluoropropoxy)biphenyl-3-yl]-1H-1,2,4-triazole-5-carboxamide

C18H12F6N4O2 (430.08644039999996)


   

4-Carbamoyl-4-{[6-(difluoro-phosphono-methyl)-naphthalene-2-carbonyl]-amino}-butyric acid

4-Carbamoyl-4-{[6-(difluoro-phosphono-methyl)-naphthalene-2-carbonyl]-amino}-butyric acid

C17H17F2N2O7P (430.0741406)


   

N-(5-Chloro-1,3-benzodioxol-4-YL)-N-(3,4,5-trimethoxyphenyl)pyrimidine-2,4-diamine

N-(5-Chloro-1,3-benzodioxol-4-YL)-N-(3,4,5-trimethoxyphenyl)pyrimidine-2,4-diamine

C20H19ClN4O5 (430.10439140000005)


   

N-[1-(5-Bromo-2,3-Dimethoxybenzyl)piperidin-4-Yl]-4-Sulfanylbutanamide

N-[1-(5-Bromo-2,3-Dimethoxybenzyl)piperidin-4-Yl]-4-Sulfanylbutanamide

C18H27BrN2O3S (430.09256519999997)


   

Chrysin-7-O-beta-D-glucoronide

Chrysin-7-O-beta-D-glucoronide

C21H18O10 (430.0899928)


   

Formononetin-B-D-glucuronide sodium salt

3,4,5-trihydroxy-6-{[3-(4-hydroxyphenyl)-4-oxo-4H-chromen-7-yl]oxy}oxane-2-carboxylic acid

C21H18O10 (430.0899928)


   

(4aS,5S,12aS)-2-carbamoyl-4a,5,10,11,12a-pentahydroxy-8-methoxy-3,12-dioxo-4,5-dihydrotetracen-1-olate

(4aS,5S,12aS)-2-carbamoyl-4a,5,10,11,12a-pentahydroxy-8-methoxy-3,12-dioxo-4,5-dihydrotetracen-1-olate

C20H16NO10- (430.0774176)


   
   

Calcium 2,3,4,5,6-pentahydroxyhexanoate

Calcium 2,3,4,5,6-pentahydroxyhexanoate

C12H22CaO14 (430.06354220000003)


   

6-[(2R,3S,4S,6S)-3,4-dihydroxy-6-methyl-5-oxooxan-2-yl]-2-(3,4-dihydroxyphenyl)-5,7-dihydroxychromen-4-one

6-[(2R,3S,4S,6S)-3,4-dihydroxy-6-methyl-5-oxooxan-2-yl]-2-(3,4-dihydroxyphenyl)-5,7-dihydroxychromen-4-one

C21H18O10 (430.0899928)


   

Coumestrol 3-O-glucoside

Coumestrol 3-O-glucoside

C21H18O10 (430.0899928)


   

Chloro(subphthalocyaninato)boron

Chloro(subphthalocyaninato)boron

C24H12BClN6 (430.0904972)


   

5-(1,3-benzodioxol-5-yl)-N-(2-furanylmethyl)-7-(trifluoromethyl)-2-pyrazolo[1,5-a]pyrimidinecarboxamide

5-(1,3-benzodioxol-5-yl)-N-(2-furanylmethyl)-7-(trifluoromethyl)-2-pyrazolo[1,5-a]pyrimidinecarboxamide

C20H13F3N4O4 (430.08888540000004)


   

2-Methoxybenzoic acid 4-[[5-(1-naphthalenyl)-1,3,4-oxadiazol-2-yl]thio]but-2-ynyl ester

2-Methoxybenzoic acid 4-[[5-(1-naphthalenyl)-1,3,4-oxadiazol-2-yl]thio]but-2-ynyl ester

C24H18N2O4S (430.0987228)


   

2-(5-bromothiophen-2-yl)-N-(4-methylpiperazin-1-yl)quinoline-4-carboxamide

2-(5-bromothiophen-2-yl)-N-(4-methylpiperazin-1-yl)quinoline-4-carboxamide

C19H19BrN4OS (430.0462864)


   

N-[5-[[2-(2-methyl-2,3-dihydroindol-1-yl)-2-oxoethyl]thio]-1,3,4-thiadiazol-2-yl]-2-thiophen-2-ylacetamide

N-[5-[[2-(2-methyl-2,3-dihydroindol-1-yl)-2-oxoethyl]thio]-1,3,4-thiadiazol-2-yl]-2-thiophen-2-ylacetamide

C19H18N4O2S3 (430.0591848)


   

3-[[[[[5-(4-Chlorophenyl)-2-furanyl]-oxomethyl]amino]-sulfanylidenemethyl]amino]-4-methoxybenzoic acid

3-[[[[[5-(4-Chlorophenyl)-2-furanyl]-oxomethyl]amino]-sulfanylidenemethyl]amino]-4-methoxybenzoic acid

C20H15ClN2O5S (430.03901700000006)


   

1-(3,4-Dichlorophenyl)-3-[diethoxyphosphoryl(phenyl)methyl]urea

1-(3,4-Dichlorophenyl)-3-[diethoxyphosphoryl(phenyl)methyl]urea

C18H21Cl2N2O4P (430.06159360000004)


   

3-(4-Methylphenyl)sulfonylpropanoic acid [2-[(3,5-dichloro-2-pyridinyl)amino]-2-oxoethyl] ester

3-(4-Methylphenyl)sulfonylpropanoic acid [2-[(3,5-dichloro-2-pyridinyl)amino]-2-oxoethyl] ester

C17H16Cl2N2O5S (430.0156946)


   

3-(Benzenesulfonyl)propanoic acid [2-[(3,5-dichloro-4-methyl-2-pyridinyl)amino]-2-oxoethyl] ester

3-(Benzenesulfonyl)propanoic acid [2-[(3,5-dichloro-4-methyl-2-pyridinyl)amino]-2-oxoethyl] ester

C17H16Cl2N2O5S (430.0156946)


   
   
   

6-[(2S,3S,5R,6R)-3,5-dihydroxy-6-(hydroxymethyl)-4-oxooxan-2-yl]-5,7-dihydroxy-2-(4-hydroxyphenyl)chromen-4-one

6-[(2S,3S,5R,6R)-3,5-dihydroxy-6-(hydroxymethyl)-4-oxooxan-2-yl]-5,7-dihydroxy-2-(4-hydroxyphenyl)chromen-4-one

C21H18O10 (430.0899928)


   

Syn-15-tert-butyl-18-methoxy-2,11-dithia-5,6,7,9-tetrafluoro(3.3)metacyclophane

Syn-15-tert-butyl-18-methoxy-2,11-dithia-5,6,7,9-tetrafluoro(3.3)metacyclophane

C21H22F4OS2 (430.104813)


   
   

(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[4-(7-hydroxy-4-oxo-1-benzopyran-3-yl)phenoxy]-2-oxanecarboxylic acid

(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[4-(7-hydroxy-4-oxo-1-benzopyran-3-yl)phenoxy]-2-oxanecarboxylic acid

C21H18O10 (430.0899928)