Exact Mass: 415.0991

Exact Mass Matches: 415.0991

Found 189 metabolites which its exact mass value is equals to given mass value 415.0991, within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error 0.01 dalton.

Cephalosporin C

(6R,7R)-3-[(acetyloxy)methyl]-7-{[(5R)-5-amino-5-carboxy-1-hydroxypentylidene]amino}-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

C16H21N3O8S (415.1049)


Cephalosporin C is an antibiotic of the cephalosporin class. It was isolated from fungi of the genus Acremonium and first characterized in 1961. Although not a very active antibiotic itself, synthetic analogs of cephalosporin C, such as cefalotin, became some of the first marketed cephalosporin antibiotic drugs. (Wikipedia) D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D002511 - Cephalosporins D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D047090 - beta-Lactams D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D007769 - Lactams

   

N6-(delta2-isopentenyl)-adenosine 5'-monophosphate

{[(2R,3S,4R,5R)-3,4-dihydroxy-5-{6-[(3-methylbut-2-en-1-yl)amino]-9H-purin-9-yl}oxolan-2-yl]methoxy}phosphonic acid

C15H22N5O7P (415.1257)


N6-(delta2-isopentenyl)-adenosine 5-monophosphate, also known as n6-(dimethylallyl)adenosine 5-phosphate or isopentenyl-amp, is a member of the class of compounds known as purine ribonucleoside monophosphates. Purine ribonucleoside monophosphates are nucleotides consisting of a purine base linked to a ribose to which one monophosphate group is attached. N6-(delta2-isopentenyl)-adenosine 5-monophosphate is slightly soluble (in water) and a moderately acidic compound (based on its pKa). N6-(delta2-isopentenyl)-adenosine 5-monophosphate can be found in a number of food items such as arctic blackberry, japanese pumpkin, lichee, and acorn, which makes n6-(delta2-isopentenyl)-adenosine 5-monophosphate a potential biomarker for the consumption of these food products. N6-(Δ2-isopentenyl)-adenosine 5-monophosphate, also known as n6-(dimethylallyl)adenosine 5-phosphate or isopentenyl-amp, is a member of the class of compounds known as purine ribonucleoside monophosphates. Purine ribonucleoside monophosphates are nucleotides consisting of a purine base linked to a ribose to which one monophosphate group is attached. N6-(Δ2-isopentenyl)-adenosine 5-monophosphate is slightly soluble (in water) and a moderately acidic compound (based on its pKa). N6-(Δ2-isopentenyl)-adenosine 5-monophosphate can be found in a number of food items such as arctic blackberry, japanese pumpkin, lichee, and acorn, which makes n6-(Δ2-isopentenyl)-adenosine 5-monophosphate a potential biomarker for the consumption of these food products. D006133 - Growth Substances > D010937 - Plant Growth Regulators > D003583 - Cytokinins

   

(1S,3S)-(R)-Cyano(3-phenoxyphenyl)methyl 3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate

alpha-Cyano(3-phenoxyphenyl)methyl (+-)cis,trans-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylic acid

C22H19Cl2NO3 (415.0742)


P - Antiparasitic products, insecticides and repellents > P03 - Ectoparasiticides, incl. scabicides, insecticides and repellents > P03B - Insecticides and repellents > P03BA - Pyrethrines D010575 - Pesticides > D007306 - Insecticides > D011722 - Pyrethrins D016573 - Agrochemicals Same as: D07763

   

Floridin

1-{[(6R,7R)-2-carboxylato-7-{[1-hydroxy-2-(thiophen-2-yl)ethylidene]amino}-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl]methyl}pyridin-1-ium

C19H17N3O4S2 (415.066)


J - Antiinfectives for systemic use > J01 - Antibacterials for systemic use > J01D - Other beta-lactam antibacterials > J01DB - First-generation cephalosporins D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D002511 - Cephalosporins 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 It is used in food processing as a filtration agent and flocculating agent Same as: D01075

   

Chlorobiocic acid

Chlorobiocic acid

C21H18ClNO6 (415.0823)


D000970 - Antineoplastic Agents > D059003 - Topoisomerase Inhibitors > D059005 - Topoisomerase II Inhibitors D004791 - Enzyme Inhibitors

   

Cylindrospermopsin

2,4(1h,3h)-pyrimidinedione, 6-((R)-hydroxy((2AS,3R,4S,5AS,7R)-2,2A,3,4,5,5A,6,7-octahydro-3-methyl-4-(sulfooxy)-1h-1,8,8B-triazaacenaphthylen-7-yl)methyl)-

C15H21N5O7S (415.1162)


A triazaacenaphthylene that is 2,2a,3,4,5,5a,6,7-octahydro-1H-1,8,8b-triazaacenaphthylene which is substituted at positions 3, 4, and 7 by methyl, sulfooxy, and (2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)(hydroxy)methyl groups, respectively (the 2aS,3R,4S,5aS,7R stereoisomer in which the carbon bearing the hydroxy group has R configuration). It is a cyanotoxin produced by several species of freshwater cyanobacteria, such as Aphanizomenon ovalisporum.

   

Validoxylamine A 7-phosphate

Validoxylamine A 7-phosphate

C14H26NO11P (415.1243)


A cyclitol phosphate that is validoxylamine A carrying a single monophosphate substituent at position 7.

   

2-(S-Glutathionyl)hydroquinone

2-(S-Glutathionyl)hydroquinone

C16H21N3O8S (415.1049)


   

Alphamethrin

alpha-Cypermethrin

C22H19Cl2NO3 (415.0742)


D010575 - Pesticides > D007306 - Insecticides > D011722 - Pyrethrins D016573 - Agrochemicals

   

(-)-Epicyclindrospermopsin

(-)-Epicyclindrospermopsin

C15H21N5O7S (415.1162)


   

Tenalisib

Tenalisib

C23H18FN5O2 (415.1444)


C274 - Antineoplastic Agent > C163758 - Targeted Therapy Agent > C2152 - Phosphatidylinositide 3-Kinase Inhibitor C274 - Antineoplastic Agent > C2189 - Signal Transduction Inhibitor > C129824 - Antineoplastic Protein Inhibitor D004791 - Enzyme Inhibitors > D000081082 - Phosphoinositide-3 Kinase Inhibitors C471 - Enzyme Inhibitor > C129825 - Antineoplastic Enzyme Inhibitor C274 - Antineoplastic Agent > C1742 - Angiogenesis Inhibitor C471 - Enzyme Inhibitor > C1404 - Protein Kinase Inhibitor

   

6-Heptenyl glucosinolate

{[(e)-(1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]sulphanyl}oct-7-en-1-ylidene)amino]oxy}sulphonic acid

C14H25NO9S2 (415.0971)


6-Heptenyl glucosinolate is found in brassicas. 6-Heptenyl glucosinolate is present in Japanese horseradish (Wasabia japonica). Present in Japanese horseradish (Wasabia japonica). 6-Heptenyl glucosinolate is found in brassicas and wasabi.

   

Epicylindrospermopsin

{10-[(2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)(hydroxy)methyl]-5-methyl-2,11,12-triazatricyclo[6.3.1.0⁴,¹²]dodec-1(11)-en-6-yl}oxidanesulfonic acid

C15H21N5O7S (415.1162)


   

Acemetacin

2-({2-[1-(4-chlorobenzoyl)-5-methoxy-2-methyl-1H-indol-3-yl]acetyl}oxy)acetic acid

C21H18ClNO6 (415.0823)


M - Musculo-skeletal system > M01 - Antiinflammatory and antirheumatic products > M01A - Antiinflammatory and antirheumatic products, non-steroids > M01AB - Acetic acid derivatives and related substances C78272 - Agent Affecting Nervous System > C241 - Analgesic Agent > C2198 - Nonnarcotic Analgesic D018373 - Peripheral Nervous System Agents > D018689 - Sensory System Agents D002491 - Central Nervous System Agents > D000700 - Analgesics D000893 - Anti-Inflammatory Agents D018501 - Antirheumatic Agents

   

Arhalofenate

N-(2-{[2-(4-chlorophenyl)-2-[3-(trifluoromethyl)phenoxy]acetyl]oxy}ethyl)ethanimidate

C19H17ClF3NO4 (415.0798)


   

cephaloridine

1-({2-carboxy-8-oxo-7-[2-(thiophen-2-yl)acetamido]-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl}methyl)pyridin-1-ium

C19H17N3O4S2 (415.066)


   

Eleclazine

4-[(pyrimidin-2-yl)methyl]-7-[4-(trifluoromethoxy)phenyl]-2,3,4,5-tetrahydro-1,4-benzoxazepin-5-one

C21H16F3N3O3 (415.1144)


C78274 - Agent Affecting Cardiovascular System > C47793 - Antiarrhythmic Agent

   

Quisultazine

10-{1-azabicyclo[2.2.2]octan-3-yl}-N,N-dimethyl-10H-phenothiazine-2-sulphonamide

C21H25N3O2S2 (415.1388)


C78276 - Agent Affecting Digestive System or Metabolism > C29701 - Anti-ulcer Agent > C29702 - Histamine-2 Receptor Antagonist

   
   
   

N-(1,2,3-trimethoxy-10-(methylthio)-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl)acetamide

N-(1,2,3-trimethoxy-10-(methylthio)-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl)acetamide

C22H25NO5S (415.1453)


   

acemetacin

Acemetacin (Emflex)

C21H18ClNO6 (415.0823)


M - Musculo-skeletal system > M01 - Antiinflammatory and antirheumatic products > M01A - Antiinflammatory and antirheumatic products, non-steroids > M01AB - Acetic acid derivatives and related substances C78272 - Agent Affecting Nervous System > C241 - Analgesic Agent > C2198 - Nonnarcotic Analgesic D018373 - Peripheral Nervous System Agents > D018689 - Sensory System Agents D002491 - Central Nervous System Agents > D000700 - Analgesics D000893 - Anti-Inflammatory Agents D018501 - Antirheumatic Agents CONFIDENCE standard compound; INTERNAL_ID 2151 INTERNAL_ID 2151; CONFIDENCE standard compound CONFIDENCE standard compound; EAWAG_UCHEM_ID 3122 EAWAG_UCHEM_ID 3122; CONFIDENCE standard compound

   

2-(4-bromophenyl)-6-(4-methoxyphenyl)-4-phenylpyridine

2-(4-bromophenyl)-6-(4-methoxyphenyl)-4-phenylpyridine

C24H18BrNO (415.0572)


   
   
   
   

Kasugamycin monohydrochloride

Kasugamycin monohydrochloride

C14H26ClN3O9 (415.1357)


   
   

3-(5-Hydroxy-1H-indole-3-yl)-4-(1H-indole-3-yl)-1H-pyrrole-2,5-dicarboxylic acid 2-methyl ester

3-(5-Hydroxy-1H-indole-3-yl)-4-(1H-indole-3-yl)-1H-pyrrole-2,5-dicarboxylic acid 2-methyl ester

C23H17N3O5 (415.1168)


   

6-C-[(2S,5S)-prolin-5-yl]quercetin|prolinalin A

6-C-[(2S,5S)-prolin-5-yl]quercetin|prolinalin A

C20H17NO9 (415.0903)


   
   
   

3-(1H-Indole-3-yl)-4-(5-hydroxy-1H-indole-3-yl)-1H-pyrrole-2,5-dicarboxylic acid 2-methyl ester

3-(1H-Indole-3-yl)-4-(5-hydroxy-1H-indole-3-yl)-1H-pyrrole-2,5-dicarboxylic acid 2-methyl ester

C23H17N3O5 (415.1168)


   
   
   
   
   
   

Angoline hydrochloride

1,2,13-Trimethoxy-12-methyl-12,13-dihydro-[1,3]dioxolo[4,5:4,5]benzo[1,2-c]phenanthridine hydrochloride

C22H22ClNO5 (415.1186)


   

Kasugamycin Hydrochloride

Kasugamycin Hydrochloride

C14H26ClN3O9 (415.1357)


Kasugamycin hydrochloride (Ksg hydrochloride) is an antibiotic which binds both the 30S and 70S ribosome but not isolated 50S subunits. Kasugamycin hydrochloride (Ksg hydrochloride) mimics mRNA nucleotides to destabilize tRNA binding and inhibit canonical translation initiation[1][2].

   

Cephalosporin C

Cephalosporin C

C16H21N3O8S (415.1049)


A cephalosporin antibiotic carrying a 3-acetoxymethyl substituent and a 6-oxo-N(6)-L-lysino group at position 7. D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D002511 - Cephalosporins D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D047090 - beta-Lactams D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D007769 - Lactams

   

Cephalosporin C_major

Cephalosporin C_major

C16H21N3O8S (415.1049)


   
   
   
   
   

6-Heptenyl glucosinolate

{[(E)-(1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]sulfanyl}oct-7-en-1-ylidene)amino]oxy}sulfonic acid

C14H25NO9S2 (415.0971)


   
   

HALOFENATE

HALOFENATE

C19H17ClF3NO4 (415.0798)


D018501 - Antirheumatic Agents > D006074 - Gout Suppressants > D014528 - Uricosuric Agents C78276 - Agent Affecting Digestive System or Metabolism > C29703 - Antilipidemic Agent D057847 - Lipid Regulating Agents > D000960 - Hypolipidemic Agents C26170 - Protective Agent > C921 - Uricosuric Agent D009676 - Noxae > D000963 - Antimetabolites

   
   

N-(3-((5-chloro-1H-pyrrolo[2,3-b]pyridin-3-yl)(hydroxy)Methyl)-2,4-difluorophenyl)propane-1-sulfonamide

N-(3-((5-chloro-1H-pyrrolo[2,3-b]pyridin-3-yl)(hydroxy)Methyl)-2,4-difluorophenyl)propane-1-sulfonamide

C17H16ClF2N3O3S (415.0569)


   

DIETHYLENETRIAMINEPENTAACETATE

DIETHYLENETRIAMINEPENTAACETATE

C14H22N3NaO10 (415.1203)


   

4-n-fmoc-amino-4-carboxy-1,1-dioxa-tetrahydrothiopyran

4-n-fmoc-amino-4-carboxy-1,1-dioxa-tetrahydrothiopyran

C21H21NO6S (415.109)


   

2,4-Pentanedione - indium (3:1)

2,4-Pentanedione - indium (3:1)

C15H24InO6 (415.0612)


   

(1S)-cis-(alphaS)-cypermethrin

[(S)-cyano-(3-phenoxyphenyl)methyl] (1S,3S)-3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylate

C22H19Cl2NO3 (415.0742)


   

Thiazolidine, 2-(2,5-dimethoxyphenyl)-3-(1-naphthalenylsulfonyl)- (9CI)

Thiazolidine, 2-(2,5-dimethoxyphenyl)-3-(1-naphthalenylsulfonyl)- (9CI)

C21H21NO4S2 (415.0912)


   

methyl N-[4-[(2-chloro-4-nitrophenyl)azo]phenyl]-N-(2-cyanoethyl)-beta-alaninate

methyl N-[4-[(2-chloro-4-nitrophenyl)azo]phenyl]-N-(2-cyanoethyl)-beta-alaninate

C19H18ClN5O4 (415.1047)


   

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

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

C21H21NO4S2 (415.0912)


   

(1S,2S,3R,5S)-(+)-2,3-PINANEDIOL4-BROMOBUTYLBORONATEESTER

(1S,2S,3R,5S)-(+)-2,3-PINANEDIOL4-BROMOBUTYLBORONATEESTER

C22H19Cl2NO3 (415.0742)


   

alpha-cyano-3-phenoxybenzyl [1R-[1alpha(R*),3beta]]-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate

alpha-cyano-3-phenoxybenzyl [1R-[1alpha(R*),3beta]]-3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate

C22H19Cl2NO3 (415.0742)


   

2-Methylthio-5-(tributylstannyl)pyridine

2-Methylthio-5-(tributylstannyl)pyridine

C18H33NSSn (415.1356)


   
   

codeine phosphate

codeine phosphate

C18H26NO8P (415.1396)


   

N-(2-Chloroethyl)-N-[2-[(3,4-dimethoxyphenyl)thio]-1-methylethyl]benzenemethanamine hydrochloride

N-(2-Chloroethyl)-N-[2-[(3,4-dimethoxyphenyl)thio]-1-methylethyl]benzenemethanamine hydrochloride

C20H27Cl2NO2S (415.1139)


   

TERT-BUTYL 4-(2-((METHYLSULFONYL)OXY)ETHYL)-4-(((METHYLSULFONYL)OXY)METHYL)PIPERIDINE-1-CARBOXYLATE

TERT-BUTYL 4-(2-((METHYLSULFONYL)OXY)ETHYL)-4-(((METHYLSULFONYL)OXY)METHYL)PIPERIDINE-1-CARBOXYLATE

C15H29NO8S2 (415.1335)


   

1,3-dimethyl-5-[6-(phenylthio)benz[cd]indol-2(1H)-ylidene]barbituric acid

1,3-dimethyl-5-[6-(phenylthio)benz[cd]indol-2(1H)-ylidene]barbituric acid

C23H17N3O3S (415.0991)


   
   
   

N-[(10-Oxido-9,10-dihydro-9-oxa-10-phosphaphenanthrene)methyl]-6-phenyl-1,3,5-triazine-2,4-diamine

N-[(10-Oxido-9,10-dihydro-9-oxa-10-phosphaphenanthrene)methyl]-6-phenyl-1,3,5-triazine-2,4-diamine

C22H18N5O2P (415.1198)


   

Milenperone

Milenperone-d4

C22H23ClFN3O2 (415.1463)


C78272 - Agent Affecting Nervous System > C28197 - Antianxiety Agent

   

1,2:5,6-Di-O-isopropyliden-3-toluol-p-sulfonat-α-D-allofuranose-3-d

1,2:5,6-Di-O-isopropyliden-3-toluol-p-sulfonat-α-D-allofuranose-3-d

C19H25DO8S (415.1411)


   

(S)-benzyl 2-(8-amino-1-bromoimidazo[1,5-a]pyrazin-3-yl)pyrrolidine-1-carboxylate

(S)-benzyl 2-(8-amino-1-bromoimidazo[1,5-a]pyrazin-3-yl)pyrrolidine-1-carboxylate

C18H18BrN5O2 (415.0644)


   
   

Cyano(3-phenoxyphenyl)methyl 3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate

Cyano(3-phenoxyphenyl)methyl 3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropanecarboxylate

C22H19Cl2NO3 (415.0742)


   

α-cypermethrin

(1R)-trans-(αS)-cypermethrin

C22H19Cl2NO3 (415.0742)


D010575 - Pesticides > D007306 - Insecticides > D011722 - Pyrethrins D016573 - Agrochemicals

   

NEDOCROMIL SODIUM

NEDOCROMIL SODIUM

C19H15NNa2O7 (415.0644)


C78272 - Agent Affecting Nervous System > C241 - Analgesic Agent > C2198 - Nonnarcotic Analgesic D000893 - Anti-Inflammatory Agents > D000082142 - Mast Cell Stabilizers D019141 - Respiratory System Agents > D018927 - Anti-Asthmatic Agents D018926 - Anti-Allergic Agents D007155 - Immunologic Factors

   

Arhalofenate

Arhalofenate

C19H17ClF3NO4 (415.0798)


C26170 - Protective Agent > C921 - Uricosuric Agent

   

Sulfur, [4-[[2-(1,1-difluoroethyl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]amino]phenyl]pentafluoro-, (OC-6-21)-

Sulfur, [4-[[2-(1,1-difluoroethyl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]amino]phenyl]pentafluoro-, (OC-6-21)-

C14H12F7N5S (415.0702)


   
   

theta-cypermethrin

(1S)-trans-(alphaR)-cypermethrin

C22H19Cl2NO3 (415.0742)


   

(1S)-trans-(alphaS)-cypermethrin

(1S)-trans-(alphaS)-cypermethrin

C22H19Cl2NO3 (415.0742)


   

1-[2-Nitro-4-(trifluoromethylsulfonyl)phenyl]-4-phenylpiperazine

1-[2-Nitro-4-(trifluoromethylsulfonyl)phenyl]-4-phenylpiperazine

C17H16F3N3O4S (415.0814)


   

N-(3-methylphenyl)-4-(4-nitrophenyl)-2-phenyl-5-thiazolecarboxamide

N-(3-methylphenyl)-4-(4-nitrophenyl)-2-phenyl-5-thiazolecarboxamide

C23H17N3O3S (415.0991)


   

N-(6-acetyl-3-cyano-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl)-3,4,5-trimethoxybenzamide

N-(6-acetyl-3-cyano-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl)-3,4,5-trimethoxybenzamide

C20H21N3O5S (415.1202)


   

3-(benzenesulfonyl)-N-(3-methylphenyl)-5-triazolo[1,5-a]quinazolinamine

3-(benzenesulfonyl)-N-(3-methylphenyl)-5-triazolo[1,5-a]quinazolinamine

C22H17N5O2S (415.1103)


   

2-[(6-chloro-3-pyridinyl)sulfonylamino]-N-[(4-methylphenyl)methyl]benzamide

2-[(6-chloro-3-pyridinyl)sulfonylamino]-N-[(4-methylphenyl)methyl]benzamide

C20H18ClN3O3S (415.0757)


   

8-(2-Chloro-3,4,5-trimethoxy-benzyl)-9-pent-4-ylnyl-9H-purin-6-ylamine

8-(2-Chloro-3,4,5-trimethoxy-benzyl)-9-pent-4-ylnyl-9H-purin-6-ylamine

C20H22ClN5O3 (415.1411)


   

(3,4-Dihydroxy-phenyl)-triphenyl-arsonium

(3,4-Dihydroxy-phenyl)-triphenyl-arsonium

C24H20AsO2+ (415.0679)


   

n-(m-Trifluoromethylphenyl) phenoxazine-4,6-dicarboxylic acid

n-(m-Trifluoromethylphenyl) phenoxazine-4,6-dicarboxylic acid

C21H12F3NO5 (415.0668)


   

{[(2,2-Dihydroxy-ethyl)-(2,3,4,5-tetrahydroxy-6-phosphonooxy-hexyl)-amino]-methyl}-phosphonic acid

{[(2,2-Dihydroxy-ethyl)-(2,3,4,5-tetrahydroxy-6-phosphonooxy-hexyl)-amino]-methyl}-phosphonic acid

C9H23NO13P2 (415.0645)


   

Cypermethrin

theta-cypermethrin

C22H19Cl2NO3 (415.0742)


P - Antiparasitic products, insecticides and repellents > P03 - Ectoparasiticides, incl. scabicides, insecticides and repellents > P03B - Insecticides and repellents > P03BA - Pyrethrines D010575 - Pesticides > D007306 - Insecticides > D011722 - Pyrethrins D016573 - Agrochemicals Same as: D07763

   

cefaloridine

cephaloridine

C19H17N3O4S2 (415.066)


J - Antiinfectives for systemic use > J01 - Antibacterials for systemic use > J01D - Other beta-lactam antibacterials > J01DB - First-generation cephalosporins D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D002511 - Cephalosporins 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: D01075

   

Eleclazine

Eleclazine

C21H16F3N3O3 (415.1144)


C78274 - Agent Affecting Cardiovascular System > C47793 - Antiarrhythmic Agent

   

Floridin

cefaloridine

C19H17N3O4S2 (415.066)


It is used in food processing as a filtration agent and flocculating agent

   

[(4S,5R,6S,8S,10R)-10-[(S)-(2,4-Dioxo-1H-pyrimidin-6-yl)-hydroxymethyl]-5-methyl-2,11-diaza-12-azoniatricyclo[6.3.1.04,12]dodec-1(12)-en-6-yl] sulfate

[(4S,5R,6S,8S,10R)-10-[(S)-(2,4-Dioxo-1H-pyrimidin-6-yl)-hydroxymethyl]-5-methyl-2,11-diaza-12-azoniatricyclo[6.3.1.04,12]dodec-1(12)-en-6-yl] sulfate

C15H21N5O7S (415.1162)


   

6-C-glucosyl chrysin

6-C-glucosyl chrysin

C21H19O9- (415.1029)


   

(2aS,3R,4S,5aS,7R)-7-[(R)-(2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)(hydroxy)methyl]-3-methyl-2,2a,3,4,5,5a,6,7-octahydro-1H-8,8b-diaza-1-azoniaacenaphthylen-4-yl sulfate

(2aS,3R,4S,5aS,7R)-7-[(R)-(2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)(hydroxy)methyl]-3-methyl-2,2a,3,4,5,5a,6,7-octahydro-1H-8,8b-diaza-1-azoniaacenaphthylen-4-yl sulfate

C15H21N5O7S (415.1162)


   

Adenosine 5-monophosphomorpholidate

Adenosine 5-monophosphomorpholidate

C14H20N6O7P- (415.1131)


   

(6R,7R)-7-[[(5R)-5-azaniumyl-5-carboxylatopentanoyl]amino]-3-(carbamoyloxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

(6R,7R)-7-[[(5R)-5-azaniumyl-5-carboxylatopentanoyl]amino]-3-(carbamoyloxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

C15H19N4O8S- (415.0924)


   

2-hydroxy-1-(2-methylpropyl)-4-oxo-N-(2-sulfamoylphenyl)quinoline-3-carboxamide

2-hydroxy-1-(2-methylpropyl)-4-oxo-N-(2-sulfamoylphenyl)quinoline-3-carboxamide

C20H21N3O5S (415.1202)


   

N-(3,4-dimethyl-2-sulfanylidene-5-thiazolyl)carbamic acid 2-[(2,5-dimethylphenyl)sulfonylamino]ethyl ester

N-(3,4-dimethyl-2-sulfanylidene-5-thiazolyl)carbamic acid 2-[(2,5-dimethylphenyl)sulfonylamino]ethyl ester

C16H21N3O4S3 (415.0694)


   

[5-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]-2-furanyl]-[5-hydroxy-3-methyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]methanone

[5-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]-2-furanyl]-[5-hydroxy-3-methyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]methanone

C16H16F3N5O5 (415.1103)


   
   

1-[4-(Diethylsulfamoyl)phenyl]-3-[3-(trifluoromethyl)phenyl]urea

1-[4-(Diethylsulfamoyl)phenyl]-3-[3-(trifluoromethyl)phenyl]urea

C18H20F3N3O3S (415.1177)


   

3-methyl-5-(4-morpholinylsulfonyl)-N-(2-pyridinylmethyl)-2-benzofurancarboxamide

3-methyl-5-(4-morpholinylsulfonyl)-N-(2-pyridinylmethyl)-2-benzofurancarboxamide

C20H21N3O5S (415.1202)


   

powelline Trifluoroacetic acid

powelline Trifluoroacetic acid

C19H20F3NO6 (415.1243)


A natural product found in Crinum asiaticum var. sinicum.

   

N-[(1E)-(5-bromo-2-hydroxyphenyl)methylene]-2-(2-oxo-4-phenylpyrrolidin-1-yl)acetohydrazide

N-[(1E)-(5-bromo-2-hydroxyphenyl)methylene]-2-(2-oxo-4-phenylpyrrolidin-1-yl)acetohydrazide

C19H18BrN3O3 (415.0531)


   

2-[9-(3-chloro-4-methoxyphenyl)-1,8-dioxo-3,4,5,6,7,9-hexahydro-2H-acridin-10-yl]acetic acid

2-[9-(3-chloro-4-methoxyphenyl)-1,8-dioxo-3,4,5,6,7,9-hexahydro-2H-acridin-10-yl]acetic acid

C22H22ClNO5 (415.1186)


   

7-Chloro-4-[4-(3,4-dimethylphenyl)sulfonyl-1-piperazinyl]quinoline

7-Chloro-4-[4-(3,4-dimethylphenyl)sulfonyl-1-piperazinyl]quinoline

C21H22ClN3O2S (415.1121)


   

isopropyl 4-({5-[(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-2-furoyl}amino)benzoate

isopropyl 4-({5-[(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-2-furoyl}amino)benzoate

C21H22ClN3O4 (415.1299)


   

2-(2,5-Dioxo-1-m-tolyl-pyrrolidin-3-yl)-1,3-diphenyl-isothiourea

2-(2,5-Dioxo-1-m-tolyl-pyrrolidin-3-yl)-1,3-diphenyl-isothiourea

C24H21N3O2S (415.1354)


   

N-[1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-3,5-dinitrobenzamide

N-[1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-3,5-dinitrobenzamide

C18H17N5O5S (415.095)


   

2-[[2-Methyl-5-(3-methyl-4-oxo-1-phthalazinyl)phenyl]sulfonylamino]acetic acid ethyl ester

2-[[2-Methyl-5-(3-methyl-4-oxo-1-phthalazinyl)phenyl]sulfonylamino]acetic acid ethyl ester

C20H21N3O5S (415.1202)


   

5-(2,5-dichlorophenyl)-N-[2,6-di(propan-2-yl)phenyl]-2-furancarboxamide

5-(2,5-dichlorophenyl)-N-[2,6-di(propan-2-yl)phenyl]-2-furancarboxamide

C23H23Cl2NO2 (415.1106)


   

1-(1,3-Benzodioxol-5-ylmethyl)-3-hydroxy-3-[2-(4-methylphenyl)-2-oxoethyl]-2-indolone

1-(1,3-Benzodioxol-5-ylmethyl)-3-hydroxy-3-[2-(4-methylphenyl)-2-oxoethyl]-2-indolone

C25H21NO5 (415.142)


   

N-(2-tert-butylphenyl)-2,2-dioxo-3,4-dihydro-[1,2,4]thiadiazino[3,4-b][1,3]benzothiazole-8-carboxamide

N-(2-tert-butylphenyl)-2,2-dioxo-3,4-dihydro-[1,2,4]thiadiazino[3,4-b][1,3]benzothiazole-8-carboxamide

C20H21N3O3S2 (415.1024)


   

N-{[8-(benzyloxy)-2-quinolinyl]methylene}-4-chlorobenzohydrazide

N-{[8-(benzyloxy)-2-quinolinyl]methylene}-4-chlorobenzohydrazide

C24H18ClN3O2 (415.1087)


   

9H-xanthene-9-carboxylic acid [2-[(1,1-dioxo-3-thiolanyl)-methylamino]-2-oxoethyl] ester

9H-xanthene-9-carboxylic acid [2-[(1,1-dioxo-3-thiolanyl)-methylamino]-2-oxoethyl] ester

C21H21NO6S (415.109)


   

1-Cyclopropyl-3-[6-oxo-5-(phenylmethyl)-3-benzo[b][1,4]benzothiazepinyl]urea

1-Cyclopropyl-3-[6-oxo-5-(phenylmethyl)-3-benzo[b][1,4]benzothiazepinyl]urea

C24H21N3O2S (415.1354)


   

Ethyl 4-(sec-butyl{[(3,4-dichlorophenyl)amino]carbonyl}amino)piperidine-1-carboxylate

Ethyl 4-(sec-butyl{[(3,4-dichlorophenyl)amino]carbonyl}amino)piperidine-1-carboxylate

C19H27Cl2N3O3 (415.1429)


   

N-(3,4-dimethylisoxazol-5-yl)-4-{[(1E)-3-(4-fluorophenyl)-3-oxoprop-1-enyl]amino}benzenesulfonamide

N-(3,4-dimethylisoxazol-5-yl)-4-{[(1E)-3-(4-fluorophenyl)-3-oxoprop-1-enyl]amino}benzenesulfonamide

C20H18FN3O4S (415.1002)


   
   

methyl 1-(2,4-difluorophenyl)-5-[(E)-(phenylcarbamothioylhydrazinylidene)methyl]pyrazole-4-carboxylate

methyl 1-(2,4-difluorophenyl)-5-[(E)-(phenylcarbamothioylhydrazinylidene)methyl]pyrazole-4-carboxylate

C19H15F2N5O2S (415.0914)


   

N-(4-{[2-(1,3-benzothiazol-2-yl)piperidin-1-yl]sulfonyl}phenyl)acetamide

N-(4-{[2-(1,3-benzothiazol-2-yl)piperidin-1-yl]sulfonyl}phenyl)acetamide

C20H21N3O3S2 (415.1024)


   

1-[(4-bromophenyl)methyl]-3-(4-chlorophenyl)-6,7,8,9-tetrahydro-5H-imidazo[1,2-a]azepin-1-ium

1-[(4-bromophenyl)methyl]-3-(4-chlorophenyl)-6,7,8,9-tetrahydro-5H-imidazo[1,2-a]azepin-1-ium

C21H21BrClN2+ (415.0577)


   

3-[(2-Bromo-6,11-dihydrobenzo[c][1]benzothiepin-11-yl)oxy]-1-azabicyclo[2.2.2]octane

3-[(2-Bromo-6,11-dihydrobenzo[c][1]benzothiepin-11-yl)oxy]-1-azabicyclo[2.2.2]octane

C21H22BrNOS (415.0605)


   

N-[3,5-bis(trifluoromethyl)phenyl]-2-cyclopentyl-2-phenylacetamide

N-[3,5-bis(trifluoromethyl)phenyl]-2-cyclopentyl-2-phenylacetamide

C21H19F6NO (415.1371)


   

N-(4-bromo-2-pyridinyl)-4-[(1-methyl-2-oxo-4-quinolinyl)oxy]butanamide

N-(4-bromo-2-pyridinyl)-4-[(1-methyl-2-oxo-4-quinolinyl)oxy]butanamide

C19H18BrN3O3 (415.0531)


   

[(8R,9R,10R)-9-(4-bromophenyl)-6-(2-pyridinylmethyl)-1,6-diazabicyclo[6.2.0]decan-10-yl]methanol

[(8R,9R,10R)-9-(4-bromophenyl)-6-(2-pyridinylmethyl)-1,6-diazabicyclo[6.2.0]decan-10-yl]methanol

C21H26BrN3O (415.1259)


   

[(8R,9S,10R)-9-(4-bromophenyl)-6-(2-pyridinylmethyl)-1,6-diazabicyclo[6.2.0]decan-10-yl]methanol

[(8R,9S,10R)-9-(4-bromophenyl)-6-(2-pyridinylmethyl)-1,6-diazabicyclo[6.2.0]decan-10-yl]methanol

C21H26BrN3O (415.1259)


   

[(8R,9S,10S)-9-(4-bromophenyl)-6-(2-pyridinylmethyl)-1,6-diazabicyclo[6.2.0]decan-10-yl]methanol

[(8R,9S,10S)-9-(4-bromophenyl)-6-(2-pyridinylmethyl)-1,6-diazabicyclo[6.2.0]decan-10-yl]methanol

C21H26BrN3O (415.1259)


   

[(8S,9R,10S)-9-(4-bromophenyl)-6-(2-pyridinylmethyl)-1,6-diazabicyclo[6.2.0]decan-10-yl]methanol

[(8S,9R,10S)-9-(4-bromophenyl)-6-(2-pyridinylmethyl)-1,6-diazabicyclo[6.2.0]decan-10-yl]methanol

C21H26BrN3O (415.1259)


   

[(8S,9S,10R)-9-(4-bromophenyl)-6-(2-pyridinylmethyl)-1,6-diazabicyclo[6.2.0]decan-10-yl]methanol

[(8S,9S,10R)-9-(4-bromophenyl)-6-(2-pyridinylmethyl)-1,6-diazabicyclo[6.2.0]decan-10-yl]methanol

C21H26BrN3O (415.1259)


   

[(8R,9R,10S)-9-(4-bromophenyl)-6-(2-pyridinylmethyl)-1,6-diazabicyclo[6.2.0]decan-10-yl]methanol

[(8R,9R,10S)-9-(4-bromophenyl)-6-(2-pyridinylmethyl)-1,6-diazabicyclo[6.2.0]decan-10-yl]methanol

C21H26BrN3O (415.1259)


   

[(8S,9R,10R)-9-(4-bromophenyl)-6-(2-pyridinylmethyl)-1,6-diazabicyclo[6.2.0]decan-10-yl]methanol

[(8S,9R,10R)-9-(4-bromophenyl)-6-(2-pyridinylmethyl)-1,6-diazabicyclo[6.2.0]decan-10-yl]methanol

C21H26BrN3O (415.1259)


   

[(8S,9S,10S)-9-(4-bromophenyl)-6-(2-pyridinylmethyl)-1,6-diazabicyclo[6.2.0]decan-10-yl]methanol

[(8S,9S,10S)-9-(4-bromophenyl)-6-(2-pyridinylmethyl)-1,6-diazabicyclo[6.2.0]decan-10-yl]methanol

C21H26BrN3O (415.1259)


   
   
   
   
   
   
   

2-[(5E)-5-[(4-hydroxy-3-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-3-phenylpropanoic acid

2-[(5E)-5-[(4-hydroxy-3-methoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-3-phenylpropanoic acid

C20H17NO5S2 (415.0548)


   

5-[[4-[(E)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]-2-methoxyphenoxy]methyl]furan-2-carboxylic acid

5-[[4-[(E)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]-2-methoxyphenoxy]methyl]furan-2-carboxylic acid

C23H17N3O5 (415.1168)


   

2-[(5E)-5-[(2,3-Dimethoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-2-phenylacetic acid

2-[(5E)-5-[(2,3-Dimethoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-2-phenylacetic acid

C20H17NO5S2 (415.0548)


   

[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] (E)-but-2-enoate

[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] (E)-but-2-enoate

C14H18N5O8P (415.0893)


   

(2S)-2-[1,4-Bis(methylsulfonyloxy)butyl]-1-pyrrolidinecarboxylic acid tert-butyl ester

(2S)-2-[1,4-Bis(methylsulfonyloxy)butyl]-1-pyrrolidinecarboxylic acid tert-butyl ester

C15H29NO8S2 (415.1335)


   

N(6)-(dimethylallyl)adenosine 5-monophosphate

N(6)-(dimethylallyl)adenosine 5-monophosphate

C15H22N5O7P (415.1257)


D006133 - Growth Substances > D010937 - Plant Growth Regulators > D003583 - Cytokinins

   

2-(S-Glutathionyl)hydroquinone

2-(S-Glutathionyl)hydroquinone

C16H21N3O8S (415.1049)


   

cylindrospermopsin zwitterion

cylindrospermopsin zwitterion

C15H21N5O7S (415.1162)


A zwitterion resulting from the transfer of a proton from the sulfooxy group to one of the nitrogens of the guanidine group of cylindrospermopsin.

   

2-(glutathion-S-yl)-1,4-hydroquinone

2-(glutathion-S-yl)-1,4-hydroquinone

C16H21N3O8S (415.1049)


A glutathione conjugate in which the thiol hydrogen of glutathione has been replaced by a 2,5-dihydroxyphenyl group.

   

7-epi-Cylindrospermopsin

7-epi-Cylindrospermopsin

C15H21N5O7S (415.1162)


A triazaacenaphthylene that is 2,2a,3,4,5,5a,6,7-octahydro-1H-1,8,8b-triazaacenaphthylene which is substituted at positions 3, 4, and 7 by methyl, sulfooxy, and (2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)(hydroxy)methyl groups, respectively (the 2aS,3R,4S,5aS,7R stereoisomer in which the carbon bearing the hydroxy group has S configuration). It is a cyanotoxin produced by several species of freshwater cyanobacteria, such as Aphanizomenon ovalisporum.

   
   
   

7-TFA-ap-7-Deaza-dG

7-TFA-ap-7-Deaza-dG

C16H16F3N5O5 (415.1103)


5'-O-TBDMS-dG is a modified nucleoside. 5'-O-DMT-2'-O-TBDMS-rI can be used in the synthesis of deoxyribonucleic acid or nucleic acid. 7-TFA-ap-7-Deaza-dG is a click chemistry reagent, it contains an Alkyne group and can undergo copper-catalyzed azide-alkyne cycloaddition (CuAAc) with molecules containing Azide groups.

   

ACSS2-IN-2

ACSS2-IN-2

C21H19F2N3O4 (415.1344)


ACSS2-IN-2 is an acyl-CoA synthetase short-chain family member 2 (ACSS2) inhibitor. ACSS2-IN-2 can inhibit ACSS2 activity with an IC50 value of 3.8 nM. ACSS2-IN-2 can be used for the research of several diseases, such as viral infection, metabolic disorders, neuropsychiatric diseases, inflammatory/autoimmune conditions and cancer[1].

   

BAY-179

BAY-179

C23H21N5OS (415.1467)


BAY-179 is a potent, selective, and species cross-reactive complex I inhibitor (IC50=79 μM)[1].

   

Cjoc42

Cjoc42

C20H21N3O5S (415.1202)


Cjoc42 is a compound capable of binding to gankyrin. Cjoc42 inhibits gankyrin activity in a dose-dependent manner. Cjoc42 prevents the decrease in p53 protein levels normally associated with high amounts of gankyrin. Cjoc42 restores p53-dependent transcription and sensitivity to DNA damage[1].

   

ML348

ML348

C18H17ClF3N3O3 (415.091)


ML348 (GNF-Pf-1127) is a selective and reversible acyl-protein thioesterase 1 (APT1)/lysophospholipase 1 (LYPLA1) inhibitor with an IC50 of 210 nM, and barely inhibits LYPLA2[1].

   

Z62954982

Z62954982

C20H21N3O5S (415.1202)


Z62954982 (ZINC08010136) is a potent, selective and?cell-permeable Rac1 (IC50=12 μM) inhibitor that is 4 times more effective than NSC23766 (HY-15723A) (IC50=50 μM). Z62954982?disrupts the Rac1/Tiam1 complex and decreases cytoplasmic levels of active Rac1 (GTP-bound Rac1), without affecting the activity of other Rho GTPases (such as Cdc42 or RhoA)[1][2].

   

(3r)-3-[(1s)-2-[(1s,4ar,6r,7r,8ar)-6,7-dichloro-5,5,8a-trimethyl-2-methylidene-4-oxo-hexahydronaphthalen-1-yl]-1-hydroxyethyl]-5-hydroxy-3,4-dihydropyrrol-2-one

(3r)-3-[(1s)-2-[(1s,4ar,6r,7r,8ar)-6,7-dichloro-5,5,8a-trimethyl-2-methylidene-4-oxo-hexahydronaphthalen-1-yl]-1-hydroxyethyl]-5-hydroxy-3,4-dihydropyrrol-2-one

C20H27Cl2NO4 (415.1317)


   

(6s,7s)-3-[(acetyloxy)methyl]-7-[(5-amino-5-carboxy-1-hydroxypentylidene)amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

(6s,7s)-3-[(acetyloxy)methyl]-7-[(5-amino-5-carboxy-1-hydroxypentylidene)amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

C16H21N3O8S (415.1049)


   

3-[2-(6,7-dichloro-5,5,8a-trimethyl-2-methylidene-4-oxo-hexahydronaphthalen-1-yl)-1-hydroxyethyl]-5-hydroxy-3,4-dihydropyrrol-2-one

3-[2-(6,7-dichloro-5,5,8a-trimethyl-2-methylidene-4-oxo-hexahydronaphthalen-1-yl)-1-hydroxyethyl]-5-hydroxy-3,4-dihydropyrrol-2-one

C20H27Cl2NO4 (415.1317)


   

[(4s,5r,6s,8s,10r)-10-[(r)-hydroxy(2-hydroxy-6-oxo-1h-pyrimidin-4-yl)methyl]-5-methyl-2,11,12-triazatricyclo[6.3.1.0⁴,¹²]dodec-1-en-6-yl]oxidanesulfonic acid

[(4s,5r,6s,8s,10r)-10-[(r)-hydroxy(2-hydroxy-6-oxo-1h-pyrimidin-4-yl)methyl]-5-methyl-2,11,12-triazatricyclo[6.3.1.0⁴,¹²]dodec-1-en-6-yl]oxidanesulfonic acid

C15H21N5O7S (415.1162)


   

bisindolylpyrrole cpb-53-594-4

NA

C23H17N3O5 (415.1168)


{"Ingredient_id": "HBIN018625","Ingredient_name": "bisindolylpyrrole cpb-53-594-4","Alias": "NA","Ingredient_formula": "C23H17N3O5","Ingredient_Smile": "COC(=O)C1=C(C(=C(N1)C(=O)O)C2=CNC3=CC=CC=C32)C4=CNC5=C4C=C(C=C5)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "2474","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   

bisindolylpyrrole cpb-53-594-5

NA

C23H17N3O5 (415.1168)


{"Ingredient_id": "HBIN018626","Ingredient_name": "bisindolylpyrrole cpb-53-594-5","Alias": "NA","Ingredient_formula": "C23H17N3O5","Ingredient_Smile": "COC(=O)C1=C(C(=C(N1)C(=O)O)C2=CNC3=C2C=C(C=C3)O)C4=CNC5=CC=CC=C54","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "2475","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   

5-[2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-4-oxochromen-6-yl]pyrrolidine-2-carboxylic acid

5-[2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-4-oxochromen-6-yl]pyrrolidine-2-carboxylic acid

C20H17NO9 (415.0903)


   

3-[2-(6,7-dichloro-2,5,5,8a-tetramethyl-4-oxo-4a,6,7,8-tetrahydro-1h-naphthalen-1-yl)-1-hydroxyethyl]-5-hydroxy-3,4-dihydropyrrol-2-one

3-[2-(6,7-dichloro-2,5,5,8a-tetramethyl-4-oxo-4a,6,7,8-tetrahydro-1h-naphthalen-1-yl)-1-hydroxyethyl]-5-hydroxy-3,4-dihydropyrrol-2-one

C20H27Cl2NO4 (415.1317)


   

10-ethenyl-11-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-12-oxa-6-thia-3-azatricyclo[7.4.0.0³,⁷]tridec-1(13)-en-2-one

10-ethenyl-11-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-12-oxa-6-thia-3-azatricyclo[7.4.0.0³,⁷]tridec-1(13)-en-2-one

C18H25NO8S (415.1301)


   

(4ar,12ar)-1,4a,10,11,12a-pentahydroxy-8-methoxy-3,12-dioxo-4,5-dihydrotetracene-2-carboximidic acid

(4ar,12ar)-1,4a,10,11,12a-pentahydroxy-8-methoxy-3,12-dioxo-4,5-dihydrotetracene-2-carboximidic acid

C20H17NO9 (415.0903)


   

(7s,9s,10r,11s)-10-ethenyl-11-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-12-oxa-6-thia-3-azatricyclo[7.4.0.0³,⁷]tridec-1(13)-en-2-one

(7s,9s,10r,11s)-10-ethenyl-11-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-12-oxa-6-thia-3-azatricyclo[7.4.0.0³,⁷]tridec-1(13)-en-2-one

C18H25NO8S (415.1301)


   

(2s,5r)-5-[2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-4-oxochromen-6-yl]pyrrolidine-2-carboxylic acid

(2s,5r)-5-[2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-4-oxochromen-6-yl]pyrrolidine-2-carboxylic acid

C20H17NO9 (415.0903)


   

(3r)-3-[(1s)-2-[(1s,4ar,6r,7r,8ar)-6,7-dichloro-2,5,5,8a-tetramethyl-4-oxo-4a,6,7,8-tetrahydro-1h-naphthalen-1-yl]-1-hydroxyethyl]-5-hydroxy-3,4-dihydropyrrol-2-one

(3r)-3-[(1s)-2-[(1s,4ar,6r,7r,8ar)-6,7-dichloro-2,5,5,8a-tetramethyl-4-oxo-4a,6,7,8-tetrahydro-1h-naphthalen-1-yl]-1-hydroxyethyl]-5-hydroxy-3,4-dihydropyrrol-2-one

C20H27Cl2NO4 (415.1317)


   

(2s,5s)-5-[2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-4-oxochromen-6-yl]pyrrolidine-2-carboxylic acid

(2s,5s)-5-[2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-4-oxochromen-6-yl]pyrrolidine-2-carboxylic acid

C20H17NO9 (415.0903)


   

[(2s,3r,4s,5s)-3,4-dihydroxy-5-{6-[(3-methylbut-2-en-1-yl)amino]purin-9-yl}oxolan-2-yl]methoxyphosphonic acid

[(2s,3r,4s,5s)-3,4-dihydroxy-5-{6-[(3-methylbut-2-en-1-yl)amino]purin-9-yl}oxolan-2-yl]methoxyphosphonic acid

C15H22N5O7P (415.1257)


   

3-(5-hydroxy-1h-indol-3-yl)-4-(1h-indol-3-yl)-5-(methoxycarbonyl)-1h-pyrrole-2-carboxylic acid

3-(5-hydroxy-1h-indol-3-yl)-4-(1h-indol-3-yl)-5-(methoxycarbonyl)-1h-pyrrole-2-carboxylic acid

C23H17N3O5 (415.1168)


   

[(4s,5r,6s,8s,10r)-10-[(s)-(2,6-dihydroxypyrimidin-4-yl)(hydroxy)methyl]-5-methyl-2,11,12-triazatricyclo[6.3.1.0⁴,¹²]dodec-1-en-6-yl]oxidanesulfonic acid

[(4s,5r,6s,8s,10r)-10-[(s)-(2,6-dihydroxypyrimidin-4-yl)(hydroxy)methyl]-5-methyl-2,11,12-triazatricyclo[6.3.1.0⁴,¹²]dodec-1-en-6-yl]oxidanesulfonic acid

C15H21N5O7S (415.1162)


   

5-(2-{6-[2-(dimethylamino)ethyl]-2h-1,3-benzodioxol-5-yl}-1,2-dihydroxyethenyl)-2h-1,3-benzodioxole-4-carboxylic acid

5-(2-{6-[2-(dimethylamino)ethyl]-2h-1,3-benzodioxol-5-yl}-1,2-dihydroxyethenyl)-2h-1,3-benzodioxole-4-carboxylic acid

C21H21NO8 (415.1267)


   

4-(5-hydroxy-1h-indol-3-yl)-3-(1h-indol-3-yl)-5-(methoxycarbonyl)-1h-pyrrole-2-carboxylic acid

4-(5-hydroxy-1h-indol-3-yl)-3-(1h-indol-3-yl)-5-(methoxycarbonyl)-1h-pyrrole-2-carboxylic acid

C23H17N3O5 (415.1168)


   

1,4a,10,11,12a-pentahydroxy-8-methoxy-3,12-dioxo-4,5-dihydrotetracene-2-carboximidic acid

1,4a,10,11,12a-pentahydroxy-8-methoxy-3,12-dioxo-4,5-dihydrotetracene-2-carboximidic acid

C20H17NO9 (415.0903)


   

{10-[hydroxy(2-hydroxy-6-oxo-1h-pyrimidin-4-yl)methyl]-5-methyl-2,11,12-triazatricyclo[6.3.1.0⁴,¹²]dodec-1-en-6-yl}oxidanesulfonic acid

{10-[hydroxy(2-hydroxy-6-oxo-1h-pyrimidin-4-yl)methyl]-5-methyl-2,11,12-triazatricyclo[6.3.1.0⁴,¹²]dodec-1-en-6-yl}oxidanesulfonic acid

C15H21N5O7S (415.1162)


   

(4as,12as)-1,4a,10,11,12a-pentahydroxy-8-methoxy-3,12-dioxo-4,5-dihydrotetracene-2-carboximidic acid

(4as,12as)-1,4a,10,11,12a-pentahydroxy-8-methoxy-3,12-dioxo-4,5-dihydrotetracene-2-carboximidic acid

C20H17NO9 (415.0903)


   

(7s,9s,10s,11s)-10-ethenyl-11-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-12-oxa-6-thia-3-azatricyclo[7.4.0.0³,⁷]tridec-1(13)-en-2-one

(7s,9s,10s,11s)-10-ethenyl-11-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-12-oxa-6-thia-3-azatricyclo[7.4.0.0³,⁷]tridec-1(13)-en-2-one

C18H25NO8S (415.1301)


   

[(2r,3s,4r,5r)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-5-(3-methylbut-3-en-1-yl)oxolan-2-yl]methoxyphosphonic acid

[(2r,3s,4r,5r)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-5-(3-methylbut-3-en-1-yl)oxolan-2-yl]methoxyphosphonic acid

C15H22N5O7P (415.1257)


   

(7r)-3-[(acetyloxy)methyl]-7-{[(5r)-5-amino-5-carboxy-1-hydroxypentylidene]amino}-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

(7r)-3-[(acetyloxy)methyl]-7-{[(5r)-5-amino-5-carboxy-1-hydroxypentylidene]amino}-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

C16H21N3O8S (415.1049)


   

(6r,7s)-3-[(acetyloxy)methyl]-7-{[(5s)-5-amino-5-carboxy-1-hydroxypentylidene]amino}-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

(6r,7s)-3-[(acetyloxy)methyl]-7-{[(5s)-5-amino-5-carboxy-1-hydroxypentylidene]amino}-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

C16H21N3O8S (415.1049)


   

(2z,4as,12ar)-2-[amino(hydroxy)methylidene]-4a,10,11,12a-tetrahydroxy-8-methoxy-4,5-dihydrotetracene-1,3,12-trione

(2z,4as,12ar)-2-[amino(hydroxy)methylidene]-4a,10,11,12a-tetrahydroxy-8-methoxy-4,5-dihydrotetracene-1,3,12-trione

C20H17NO9 (415.0903)


   

3-[(acetyloxy)methyl]-7-[(5-amino-5-carboxy-1-hydroxypentylidene)amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

3-[(acetyloxy)methyl]-7-[(5-amino-5-carboxy-1-hydroxypentylidene)amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

C16H21N3O8S (415.1049)


   

5-[(1e)-2-{6-[2-(dimethylamino)ethyl]-2h-1,3-benzodioxol-5-yl}-1,2-dihydroxyethenyl]-2h-1,3-benzodioxole-4-carboxylic acid

5-[(1e)-2-{6-[2-(dimethylamino)ethyl]-2h-1,3-benzodioxol-5-yl}-1,2-dihydroxyethenyl]-2h-1,3-benzodioxole-4-carboxylic acid

C21H21NO8 (415.1267)