Exact Mass: 285.0902

Exact Mass Matches: 285.0902

Found 174 metabolites which its exact mass value is equals to given mass value 285.0902, within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error 0.001 dalton.

Buchananine

ZINC00898995

C12H15NO7 (285.0848)


   

Arborinine

9(10H)-Acridinone, 1-hydroxy-2,3-dimethoxy-10-methyl- (9ci)

C16H15NO4 (285.1001)


Arborinine is found in herbs and spices. Arborinine is an alkaloid from Ruta graveolens (rue

   

Fludarabine

Fludarabine Base

C10H12FN5O4 (285.0873)


L - Antineoplastic and immunomodulating agents > L01 - Antineoplastic agents > L01B - Antimetabolites > L01BB - Purine analogues C274 - Antineoplastic Agent > C186664 - Cytotoxic Chemotherapeutic Agent > C272 - Antimetabolite C471 - Enzyme Inhibitor > C2150 - Ribonucleotide Reductase Inhibitor D000970 - Antineoplastic Agents Fludarabine (NSC 118218) is a DNA synthesis inhibitor and a fluorinated purine analogue with antineoplastic activity in lymphoproliferative malignancies. Fludarabine inhibits the cytokine-induced activation of STAT1 and STAT1-dependent gene transcription in normal resting or activated lymphocytes[1][2][3][4].

   

N-Acetylcytidine

N(4)-acetylcytidine

C11H15N3O6 (285.0961)


Cytidine in which one of the exocyclic amino hydrogens is substituted by an acetyl group. N4-Acetylcytidine is an endogenous metabolite. N4-Acetylcytidine is an endogenous metabolite.

   

4-nitrophenyl-alpha-l-fucopyranoside

p-Nitrophenyl 6-deoxy-alpha-L-galactopyranoside

C12H15NO7 (285.0848)


   

N4-Acetylcytidine

N-{1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-2-oxo-1,2-dihydropyrimidin-4-yl}acetamide

C11H15N3O6 (285.0961)


N4-Acetylcytidine is a modified nucleoside. N4-acetylcytidine is an endogenous urinary nucleoside product of the degradation of transfer ribonucleic acid (tRNA); urinary nucleosides are biological markers for patients with colorectal cancer. tRNA has been shown to be excreted in abnormal amounts in the urine of cancer patients. tRNA from neoplastic tissue had a much more rapid turnover rate than the tRNA from the corresponding normal tissue. Evidence indicates that methylation of tRNA occurs only after synthesis of the intact macromolecule. Because there are no specific enzyme systems to incorporate the modified nucleosides into the macromolecular nucleic acid, these nucleosides once released in the process of tRNA turnover cannot be reutilized, nor are they further degraded, but are excreted in urine. (PMID: 15991285, 3506820) [HMDB] N4-Acetylcytidine is a modified nucleoside. N4-acetylcytidine is an endogenous urinary nucleoside product of the degradation of transfer ribonucleic acid (tRNA); urinary nucleosides are biological markers for patients with colorectal cancer. tRNA has been shown to be excreted in abnormal amounts in the urine of cancer patients. tRNA from neoplastic tissue had a much more rapid turnover rate than the tRNA from the corresponding normal tissue. Evidence indicates that methylation of tRNA occurs only after synthesis of the intact macromolecule. Because there are no specific enzyme systems to incorporate the modified nucleosides into the macromolecular nucleic acid, these nucleosides once released in the process of tRNA turnover cannot be reutilized, nor are they further degraded, but are excreted in urine. (PMID: 15991285, 3506820). N4-Acetylcytidine is an endogenous metabolite. N4-Acetylcytidine is an endogenous metabolite.

   

Asenapine

17-chloro-4-methyl-13-oxa-4-azatetracyclo[12.4.0.0^{2,6}.0^{7,12}]octadeca-1(14),7,9,11,15,17-hexaene

C17H16ClNO (285.092)


   

2-Fluoroadenosine

2-(6-amino-2-fluoro-9H-purin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol

C10H12FN5O4 (285.0873)


   

arabinosyl-2-fluoroadenine

2-(6-amino-2-fluoro-7H-purin-8-yl)oxane-3,4,5-triol

C10H12FN5O4 (285.0873)


   

4-(2-Methoxyphenyl)-2-((5-methyl-1H-imidazol-4-yl)methyl)thiazole

4-(2-methoxyphenyl)-2-[(5-methyl-1H-imidazol-4-yl)methyl]-1,3-thiazole

C15H15N3OS (285.0936)


   

N-Benzoyl-L-tyrosine

2-{[hydroxy(phenyl)methylidene]amino}-3-(4-hydroxyphenyl)propanoate

C16H15NO4 (285.1001)


   

taxol side chain

(2R,3S)-3-(Benzoylamino)-2-hydroxy-3-phenylpropionic acid; (2R,3S)-N-Benzoyl-3-phenylisoserine; N-Benzoyl-(2R,3S)-3-phenylisoserine; Benzenepropanoic acid, beta-(benzoylamino)-alpha-hydroxy-, (alphaR,betaS)-; Benzenepropanoic acid, beta-(benzoylamino)-alpha-hydroxy-, [R-(R*,S*)]-; Taxol side chain acid

C16H15NO4 (285.1001)


N-Benzoyl-(2R,3S)-3-phenylisoserine is a Taxol C-13 Side Chain and crucial for the strong antitumor activity of Taxol[1].

   

Toddaliopsin A

Toddaliopsin A

C16H15NO4 (285.1001)


   

N-Formylismine

N-Formylismine

C16H15NO4 (285.1001)


   

Carbazomycin F

Carbazomycin F

C16H15NO4 (285.1001)


   
   
   

N-glucosylnicotinate

N-glucosylnicotinate

C12H15NO7 (285.0848)


   

CHEMBL1095074

CHEMBL1095074

C16H15NO4 (285.1001)


   

aleurodiscoester

aleurodiscoester

C12H15NO7 (285.0848)


   

CHEMBL1094823

CHEMBL1094823

C16H15NO4 (285.1001)


   

O1-(3-amino-phenyl)-beta-D-glucopyranuronic acid|O1-(3-Amino-phenyl)-beta-D-glucopyranuronsaeure

O1-(3-amino-phenyl)-beta-D-glucopyranuronic acid|O1-(3-Amino-phenyl)-beta-D-glucopyranuronsaeure

C12H15NO7 (285.0848)


   

8-isopropenyl-10-methyl-7,10-dihydro-8H-[1,3]dioxolo[4,5-h]furo[2,3-b]quinolin-6-one|Ptelefolidon|Ptelefolidone

8-isopropenyl-10-methyl-7,10-dihydro-8H-[1,3]dioxolo[4,5-h]furo[2,3-b]quinolin-6-one|Ptelefolidon|Ptelefolidone

C16H15NO4 (285.1001)


   
   

4-Aminophenyl-beta-D-glucuronide

4-Aminophenyl-beta-D-glucuronide

C12H15NO7 (285.0848)


   

MEGxm0_000317

MEGxm0_000317

C16H15NO4 (285.1001)


   

demethylmasonine

demethylmasonine

C16H15NO4 (285.1001)


   
   

(E)-2-[(3-Indole)cyanomethylene]-3-indolinone

(E)-2-[(3-Indole)cyanomethylene]-3-indolinone

C18H11N3O (285.0902)


   

3-hydroxy-2,4-dimethoxy-10-methyl-10H-acridin-9-one|3-hydroxy-2,4-dimethoxy-10-methyl-9-acridinone

3-hydroxy-2,4-dimethoxy-10-methyl-10H-acridin-9-one|3-hydroxy-2,4-dimethoxy-10-methyl-9-acridinone

C16H15NO4 (285.1001)


   

SCHEMBL21629440

SCHEMBL21629440

C16H15NO4 (285.1001)


   

1-Hydroxy-3,4-dimethoxy-10-methylacridan-9-one

1-Hydroxy-3,4-dimethoxy-10-methylacridan-9-one

C16H15NO4 (285.1001)


   

4-hydroxyphenethyl 3-oxo-2,3-dihydro-1H-pyrrolizine-2-carboxylate

4-hydroxyphenethyl 3-oxo-2,3-dihydro-1H-pyrrolizine-2-carboxylate

C16H15NO4 (285.1001)


   
   

aflaquinolone E

aflaquinolone E

C16H15NO4 (285.1001)


   

1-Hydroxy-2,3-dimethoxy-10-methylacridan-9-on

1-Hydroxy-2,3-dimethoxy-10-methylacridan-9-on

C16H15NO4 (285.1001)


   

4,9-anhydro-11-deoxyTTX

4,9-anhydro-11-deoxyTTX

C11H15N3O6 (285.0961)


   

4a,N-didehydronoraugustamine

4a,N-didehydronoraugustamine

C16H15NO4 (285.1001)


   

7,8-Dehydrorutaecarpine

7,8-Dehydrorutaecarpine

C18H11N3O (285.0902)


   

1-Hydroxy-3,5-dimethoxy-10-methylacridine-9(10H)-one

1-Hydroxy-3,5-dimethoxy-10-methylacridine-9(10H)-one

C16H15NO4 (285.1001)


   

2-Aminophenyl b-D-glucuronide HCl

2-Aminophenyl b-D-glucuronide HCl

C12H15NO7 (285.0848)


   

Nicotinic acid-hexoside

Nicotinic acid-hexoside

C12H15NO7 (285.0848)


   

2-hydroxy-1,3-dimethoxy-10-methylacridin-9-one

NCGC00384962-01!2-hydroxy-1,3-dimethoxy-10-methylacridin-9-one

C16H15NO4 (285.1001)


   

C16H15NO4_2(1H)-Quinolinone, 3,4-dihydro-3,4-dihydroxy-4-(4-methoxyphenyl)

NCGC00169065-03_C16H15NO4_2(1H)-Quinolinone, 3,4-dihydro-3,4-dihydroxy-4-(4-methoxyphenyl)-

C16H15NO4 (285.1001)


   

N4-Acetylcytidine

N4-Acetylcytidine

C11H15N3O6 (285.0961)


CONFIDENCE standard compound; INTERNAL_ID 309

   

2-hydroxy-1,3-dimethoxy-10-methylacridin-9-one [IIN-based: Match]

NCGC00384962-01!2-hydroxy-1,3-dimethoxy-10-methylacridin-9-one [IIN-based: Match]

C16H15NO4 (285.1001)


   

2-hydroxy-1,3-dimethoxy-10-methylacridin-9-one [IIN-based on: CCMSLIB00000848955]

NCGC00384962-01!2-hydroxy-1,3-dimethoxy-10-methylacridin-9-one [IIN-based on: CCMSLIB00000848955]

C16H15NO4 (285.1001)


   
   

4-Acetylcytidine

4-Acetyl-1-(beta-delta-ribofuranosyl)cytosine

C11H15N3O6 (285.0961)


N4-Acetylcytidine is an endogenous metabolite. N4-Acetylcytidine is an endogenous metabolite.

   

3,4-Dihydroxy-4-(4-methoxyphenyl)-3,4-dihydro-2(1H)-quinolinone

3,4-Dihydroxy-4-(4-methoxyphenyl)-3,4-dihydro-2(1H)-quinolinone

C16H15NO4 (285.1001)


   

3-[[2-(3-methylphenoxy)acetyl]amino]benzoic acid

3-[[2-(3-methylphenoxy)acetyl]amino]benzoic acid

C16H15NO4 (285.1001)


   

coumarin 481

2H-1-Benzopyran-2-one, 7-(diethylamino)-4-(trifluoromethyl)-

C14H14F3NO2 (285.0977)


   

(2-Methyl-5-(morpholinosulfonyl)phenyl)boronic acid

(2-Methyl-5-(morpholinosulfonyl)phenyl)boronic acid

C11H16BNO5S (285.0842)


   

Anirolac

5-(4-methoxybenzoyl)-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid

C16H15NO4 (285.1001)


C78272 - Agent Affecting Nervous System > C241 - Analgesic Agent > C2198 - Nonnarcotic Analgesic

   

2-Fluoroadenosine

2-Fluoroadenosine

C10H12FN5O4 (285.0873)


2-Fluoroadenosine (2FA) is a nucleoside analogue. 2-Fluoroadenosine has antibacterial activity with IC50 value of 0.842 mM for Vibrio microvibrio[1].

   

2-Deoxy-2-fluoroguanosine

2-Deoxy-2-fluoroguanosine

C10H12FN5O4 (285.0873)


   

Methyl 3-(5-Methyl-2-(trifluoromethyl)-1H-indol-3-yl)propanoate

Methyl 3-(5-Methyl-2-(trifluoromethyl)-1H-indol-3-yl)propanoate

C14H14F3NO2 (285.0977)


   

(3S)-3-Benzyl-7a-(trifluoromethyl)tetrahydropyrrolo[2,1-b]oxa-zol-5(6H)-one

(3S)-3-Benzyl-7a-(trifluoromethyl)tetrahydropyrrolo[2,1-b]oxa-zol-5(6H)-one

C14H14F3NO2 (285.0977)


   

(3R)-3-Benzyl-7a-(trifluoromethyl)tetrahydropyrrolo[2,1-b]oxazol-5(6H)-one

(3R)-3-Benzyl-7a-(trifluoromethyl)tetrahydropyrrolo[2,1-b]oxazol-5(6H)-one

C14H14F3NO2 (285.0977)


   

2-(3-(4-hydroxyphenyl)propanamido)benzoic acid

2-(3-(4-hydroxyphenyl)propanamido)benzoic acid

C16H15NO4 (285.1001)


   

1-(3-PYRROLIDINOPROYL)HOMOPIPERAZINE

1-(3-PYRROLIDINOPROYL)HOMOPIPERAZINE

C16H15NO2S (285.0823)


   

1-(ISOCYANO(TOSYL)METHYL)-2-METHYLBENZENE

1-(ISOCYANO(TOSYL)METHYL)-2-METHYLBENZENE

C16H15NO2S (285.0823)


   

5-METHOXY-3-(METHYLCARBAMOYL)-[1,1-BIPHENYL]-3-CARBOXYLIC ACID

5-METHOXY-3-(METHYLCARBAMOYL)-[1,1-BIPHENYL]-3-CARBOXYLIC ACID

C16H15NO4 (285.1001)


   

2-[4-(1-carboxyethyl)anilino]benzoic acid

2-[4-(1-carboxyethyl)anilino]benzoic acid

C16H15NO4 (285.1001)


   

3-[[2-(4-methylphenoxy)acetyl]amino]benzoic acid

3-[[2-(4-methylphenoxy)acetyl]amino]benzoic acid

C16H15NO4 (285.1001)


   

5-(furan-2-yl)-3-p-tolyl-4,5-dihydro-1h-pyrazole-1-carbothioamide

5-(furan-2-yl)-3-p-tolyl-4,5-dihydro-1h-pyrazole-1-carbothioamide

C15H15N3OS (285.0936)


   

3-Deoxy-3-fluoroguanosine

3-Deoxy-3-fluoroguanosine

C10H12FN5O4 (285.0873)


   
   

4-Nitrophenylrhamnoside

4-Nitrophenyl α-L-rhamnopyranoside

C12H15NO7 (285.0848)


   
   

[5-chloro-2-(cyclopropylmethylamino)phenyl]-phenylmethanone

[5-chloro-2-(cyclopropylmethylamino)phenyl]-phenylmethanone

C17H16ClNO (285.092)


   

4-nitrophenyl-beta-l-fucopyranoside

p-Nitrophenyl 6-deoxy-beta-L-galactopyranoside

C12H15NO7 (285.0848)


   

4-AMINO-N-(2,3-DIMETHYLPHENYL)BENZAMIDE

4-AMINO-N-(2,3-DIMETHYLPHENYL)BENZAMIDE

C12H16ClN3O3 (285.088)


   

Methyl 7-fluoro-6-(phenylamino)-1H-benzo[d]imidazole-5-carboxylate

Methyl 7-fluoro-6-(phenylamino)-1H-benzo[d]imidazole-5-carboxylate

C15H12FN3O2 (285.0914)


   
   

Adenosine, 8-fluoro-

Adenosine, 8-fluoro-

C10H12FN5O4 (285.0873)


   

benzyl N-(1-hydroxy-2-oxo-2-phenylethyl)carbamate

benzyl N-(1-hydroxy-2-oxo-2-phenylethyl)carbamate

C16H15NO4 (285.1001)


   

Asenapine

(3aS,12bS)-2-Methyl-2,3,3a,12b-tetrahydro-1H-dibenzo[2,3:6,7]oxepino[4,5-c]pyrrole

C17H16ClNO (285.092)


N - Nervous system > N05 - Psycholeptics > N05A - Antipsychotics > N05AH - Diazepines, oxazepines, thiazepines and oxepines D002492 - Central Nervous System Depressants > D014149 - Tranquilizing Agents > D014150 - Antipsychotic Agents D002491 - Central Nervous System Agents > D011619 - Psychotropic Drugs > D014149 - Tranquilizing Agents D002491 - Central Nervous System Agents > D002492 - Central Nervous System Depressants An organic heterotetracyclic compound that is 2,3,3a,12b-tetrahydrodibenzo[2,3:6,7]oxepino[4,5-c]pyrrole bearing methyl and chloro substituents at positions 2 and 5 respectively. C78272 - Agent Affecting Nervous System > C29710 - Antipsychotic Agent Asenapine (Org 5222), an atypical antipsychotic, is an antagonist of serotonin receptors (pKi: 8.4-10.5), adrenoceptors (pKi: 8.9-9.5), dopamine receptors (pKi: 8.9-9.4) and histamine receptors (pKi: 8.2-9.0). Asenapine can be used in the research of schizophrenia and bipolar disorder[1][2].

   

1-propenyl-2,3-diMethyliMidazoliuM hexafluorophosphate

1-propenyl-2,3-diMethyliMidazoliuM hexafluorophosphate

C8H16F6N2P (285.0955)


   

DIETHYL(3-AMINOPROPYL)PHOSPHONATE OXALATE SALT

DIETHYL(3-AMINOPROPYL)PHOSPHONATE OXALATE SALT

C9H20NO7P (285.0977)


   

(4-(N-(3-Methylbutanoyl)sulfamoyl)phenyl)boronic acid

(4-(N-(3-Methylbutanoyl)sulfamoyl)phenyl)boronic acid

C11H16BNO5S (285.0842)


   

1,3-Dimethoxy-5-[2-(4-nitro-phenyl)-vinyl]-benzene

1,3-Dimethoxy-5-[2-(4-nitro-phenyl)-vinyl]-benzene

C16H15NO4 (285.1001)


   

2-nitrophenyl β-D-fucoside

Orthonitrophenyl-beta-D-fucopyranoside

C12H15NO7 (285.0848)


   

1-(ISOCYANO(TOSYL)METHYL)-3-METHYLBENZENE

1-(ISOCYANO(TOSYL)METHYL)-3-METHYLBENZENE

C16H15NO2S (285.0823)


   

4-nitrophenyl-beta-d-fucopyranoside

4-nitrophenyl-beta-d-fucopyranoside

C12H15NO7 (285.0848)


   

7-benzoyl-2,4-dimethyl-2,4,7,8,9-pentazabicyclo[4.3.0]nona-8,10-diene-3,5-dione

7-benzoyl-2,4-dimethyl-2,4,7,8,9-pentazabicyclo[4.3.0]nona-8,10-diene-3,5-dione

C13H11N5O3 (285.0862)


   

n-benzoyl-l-tyrosine

n-benzoyl-l-tyrosine

C16H15NO4 (285.1001)


   

3-Benzyloxy-4-methoxy-beta-nitrostyrene

3-Benzyloxy-4-methoxy-beta-nitrostyrene

C16H15NO4 (285.1001)


   

4-benzyloxy-3-methoxy-omega-nitrostyrene

4-benzyloxy-3-methoxy-omega-nitrostyrene

C16H15NO4 (285.1001)


   

8-(4-fluorophenyl)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine

8-(4-fluorophenyl)-2-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine

C13H11F4N3 (285.0889)


   

4-(4-(HYDROXYMETHYL)-2-METHOXY-5-NITROPHENOXY)BUTANOIC ACID

4-(4-(HYDROXYMETHYL)-2-METHOXY-5-NITROPHENOXY)BUTANOIC ACID

C12H15NO7 (285.0848)


   

Trans-3-benzyloxy-4-methoxy-beta-nitrostyrene

Trans-3-benzyloxy-4-methoxy-beta-nitrostyrene

C16H15NO4 (285.1001)


   

L-GAMMA-GLUTAMYL-P-NITROANILIDE MONOHYDRATE

L-GAMMA-GLUTAMYL-P-NITROANILIDE MONOHYDRATE

C11H15N3O6 (285.0961)


   

2-(4-Dimethylamino-2-hydroxy-benzoyl)-benzoic acid

2-(4-Dimethylamino-2-hydroxy-benzoyl)-benzoic acid

C16H15NO4 (285.1001)


   

N-(4-Cyclopropyl-1-naphthalenyl)-2-formylhydrazinecarbothioamide

N-(4-Cyclopropyl-1-naphthalenyl)-2-formylhydrazinecarbothioamide

C15H15N3OS (285.0936)


   

2-{[(4-Methoxy-3-Methyl-2-Pyridinyl)Methyl]Sulfanyl}-1H-Benzimidazole

2-{[(4-Methoxy-3-Methyl-2-Pyridinyl)Methyl]Sulfanyl}-1H-Benzimidazole

C15H15N3OS (285.0936)


   

(4-Methoxy-3-(pyrrolidin-1-ylsulfonyl)phenyl)boronic acid

(4-Methoxy-3-(pyrrolidin-1-ylsulfonyl)phenyl)boronic acid

C11H16BNO5S (285.0842)


   

(2-Methyl-4-(morpholinosulfonyl)phenyl)boronic acid

(2-Methyl-4-(morpholinosulfonyl)phenyl)boronic acid

C11H16BNO5S (285.0842)


   

2′-Deoxy-2′-fluoroguanosine

2′-Deoxy-2′-fluoroguanosine

C10H12FN5O4 (285.0873)


2′-Deoxy-2′-fluoroguanosine, a nucleoside analog, is a potent inhibitor of influenza virus strains, with an EC90 of <0.35 μM for influenza virus A and B strains. 2′-Deoxy-2′-fluoroguanosine significantly inhibits replication of influenza virus in the upper respiratory tract, resulting in amelioration of fever and nasal inflammation[1][2].

   

2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1-benzothiophene-5-carbonitrile

2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1-benzothiophene-5-carbonitrile

C15H16BNO2S (285.0995)


   

2-AMINOPHENYL-β-D-GLUCURONIC ACID

2-AMINOPHENYL-β-D-GLUCURONIC ACID

C12H15NO7 (285.0848)


   

1-Isocyano-2-phenylethyl 4-methylphenyl sulfone

1-Isocyano-2-phenylethyl 4-methylphenyl sulfone

C16H15NO2S (285.0823)


   
   

Dibenzyl imidodicarbonate

Dibenzyl imidodicarbonate

C16H15NO4 (285.1001)


   

N-(beta-D-glucosyl)nicotinate

N-(beta-D-glucosyl)nicotinate

C12H15NO7 (285.0848)


   

2-(6-Amino-2-fluoropurin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol

2-(6-Amino-2-fluoropurin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol

C10H12FN5O4 (285.0873)


D000970 - Antineoplastic Agents

   

2-Benzamido-3-(4-hydroxyphenyl)propanoic acid

2-Benzamido-3-(4-hydroxyphenyl)propanoic acid

C16H15NO4 (285.1001)


   

N-(2-furanylmethyl)-3-methyl-7,8-dihydro-6H-cyclopenta[4,5]thieno[1,2-c]pyrimidin-1-amine

N-(2-furanylmethyl)-3-methyl-7,8-dihydro-6H-cyclopenta[4,5]thieno[1,2-c]pyrimidin-1-amine

C15H15N3OS (285.0936)


   

2-[(1-Oxo-2-phenoxyethyl)amino]benzoic acid methyl ester

2-[(1-Oxo-2-phenoxyethyl)amino]benzoic acid methyl ester

C16H15NO4 (285.1001)


   

3-[2-(3-Methylphenoxy)ethyl]-1,3-benzothiazol-2-one

3-[2-(3-Methylphenoxy)ethyl]-1,3-benzothiazol-2-one

C16H15NO2S (285.0823)


   

3-[2-(4-Methylphenoxy)ethyl]-1,3-benzothiazol-2-one

3-[2-(4-Methylphenoxy)ethyl]-1,3-benzothiazol-2-one

C16H15NO2S (285.0823)


   

Acetamide, N-(2,3-dihydroxy-5-(4-methylbenzoyl)phenyl)-

Acetamide, N-(2,3-dihydroxy-5-(4-methylbenzoyl)phenyl)-

C16H15NO4 (285.1001)


   

2-(3-Benzoylphenoxy)ethyl(hydroxy)formamide

2-(3-Benzoylphenoxy)ethyl(hydroxy)formamide

C16H15NO4 (285.1001)


   

3,4-Dihydroxy-4-(4-methoxyphenyl)-1,3-dihydroquinolin-2-one

3,4-Dihydroxy-4-(4-methoxyphenyl)-1,3-dihydroquinolin-2-one

C16H15NO4 (285.1001)


   

N-[1-[(2R,3S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-oxopyrimidin-4-yl]acetamide

N-[1-[(2R,3S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-oxopyrimidin-4-yl]acetamide

C11H15N3O6 (285.0961)


   

2-(6-amino-2-fluoro-7H-purin-8-yl)oxane-3,4,5-triol

2-(6-amino-2-fluoro-7H-purin-8-yl)oxane-3,4,5-triol

C10H12FN5O4 (285.0873)


   

4-butyl-3-(4-chloro-1,5-dimethyl-3-pyrazolyl)-1H-1,2,4-triazole-5-thione

4-butyl-3-(4-chloro-1,5-dimethyl-3-pyrazolyl)-1H-1,2,4-triazole-5-thione

C11H16ClN5S (285.0815)


   

N-(1-propyl-5-benzimidazolyl)-2-thiophenecarboxamide

N-(1-propyl-5-benzimidazolyl)-2-thiophenecarboxamide

C15H15N3OS (285.0936)


   

1-Butyl-3-[[(4,5-dimethyl-3-thiophenyl)-oxomethyl]amino]thiourea

1-Butyl-3-[[(4,5-dimethyl-3-thiophenyl)-oxomethyl]amino]thiourea

C12H19N3OS2 (285.0969)


   

N-[3-(6-imidazo[2,1-b]thiazolyl)phenyl]butanamide

N-[3-(6-imidazo[2,1-b]thiazolyl)phenyl]butanamide

C15H15N3OS (285.0936)


   

(2R,5R)-2-(6-amino-2-fluoro-9-purinyl)-5-(hydroxymethyl)oxolane-3,4-diol

(2R,5R)-2-(6-amino-2-fluoro-9-purinyl)-5-(hydroxymethyl)oxolane-3,4-diol

C10H12FN5O4 (285.0873)


   

5-[2-(2,6-Difluorophenyl)ethyl]-8-quinolinol

5-[2-(2,6-Difluorophenyl)ethyl]-8-quinolinol

C17H13F2NO (285.0965)


   

N-(D-glucopyranosyl)nicotinate

N-(D-glucopyranosyl)nicotinate

C12H15NO7 (285.0848)


   

3-Methyl-4-thiophen-2-yl-2,4,4a,6,7,8-hexahydropyrazolo[3,4-b]quinolin-5-one

3-Methyl-4-thiophen-2-yl-2,4,4a,6,7,8-hexahydropyrazolo[3,4-b]quinolin-5-one

C15H15N3OS (285.0936)


   

(1R,10S,11R,12R,13S,14R)-3-amino-11-(hydroxymethyl)-6,9-dioxa-2,4-diazapentacyclo[8.3.1.01,7.05,13.08,12]tetradec-3-ene-8,11,14-triol

(1R,10S,11R,12R,13S,14R)-3-amino-11-(hydroxymethyl)-6,9-dioxa-2,4-diazapentacyclo[8.3.1.01,7.05,13.08,12]tetradec-3-ene-8,11,14-triol

C11H15N3O6 (285.0961)


   

1,3-Dimethoxy-2-hydroxy-10-methyl-9(10h)-acridinone

1,3-Dimethoxy-2-hydroxy-10-methyl-9(10h)-acridinone

C16H15NO4 (285.1001)


   

[3-[2-Aminoethoxy(hydroxy)phosphoryl]oxy-2-hydroxypropyl] butanoate

[3-[2-Aminoethoxy(hydroxy)phosphoryl]oxy-2-hydroxypropyl] butanoate

C9H20NO7P (285.0977)


   

3,5-Dimethyl-4-nitrobenzyl benzoate

3,5-Dimethyl-4-nitrobenzyl benzoate

C16H15NO4 (285.1001)


   

1-Acetoxy-4-(4-(N-acetylamino)phenoxy)benzene

1-Acetoxy-4-(4-(N-acetylamino)phenoxy)benzene

C16H15NO4 (285.1001)


   

(S,S)-asenapine

(S,S)-asenapine

C17H16ClNO (285.092)


A 5-chloro-2-methyl-2,3,3a,12b-tetrahydrodibenzo[2,3:6,7]oxepino[4,5-c]pyrrole in which both of the stereocentres have S configuration.

   

(R,R)-asenapine

(R,R)-asenapine

C17H16ClNO (285.092)


A 5-chloro-2-methyl-2,3,3a,12b-tetrahydrodibenzo[2,3:6,7]oxepino[4,5-c]pyrrole in which both of the stereocentres have R configuration.

   

4-nitrophenyl alpha-L-fucoside

4-nitrophenyl alpha-L-fucoside

C12H15NO7 (285.0848)


An alpha-L-fucoside that is alpha-L-fucopyranose in which the anomeric hydroxy hydrogen is replaced by a 4-nitrophenyl group.

   
   

PI3K/Akt/mTOR-IN-2

PI3K/Akt/mTOR-IN-2

C17H13F2NO (285.0965)


PI3K/Akt/mTOR-IN-2 is a PI3K/AKT/mTOR pathway inhibitor. PI3K/Akt/mTOR-IN-2 possess anti-cancer effects and selectivity against MDA-MB-231 cells with IC50 value of 2.29 μM. PI3K/Akt/mTOR-IN-2 can induce cancer cell cycle arrest and apoptosis[1].

   

7-imino-2-methyl-10,13,15-trioxa-6,8-diazapentacyclo[7.4.1.1³,¹².0⁵,¹¹.0⁵,¹⁴]pentadecane-2,4,12-triol

7-imino-2-methyl-10,13,15-trioxa-6,8-diazapentacyclo[7.4.1.1³,¹².0⁵,¹¹.0⁵,¹⁴]pentadecane-2,4,12-triol

C11H15N3O6 (285.0961)


   

4-hydroxy-2,3-dimethoxy-10-methylacridin-9-one

4-hydroxy-2,3-dimethoxy-10-methylacridin-9-one

C16H15NO4 (285.1001)


   

2-hydroxy-3-(4-methoxyphenyl)-1,2-dihydroindole-3-carboxylic acid

2-hydroxy-3-(4-methoxyphenyl)-1,2-dihydroindole-3-carboxylic acid

C16H15NO4 (285.1001)


   

2-{[(5-hydroxy-2,5-dimethyl-4,6-dioxocyclohex-2-en-1-ylidene)amino]methyl}benzaldehyde

2-{[(5-hydroxy-2,5-dimethyl-4,6-dioxocyclohex-2-en-1-ylidene)amino]methyl}benzaldehyde

C16H15NO4 (285.1001)


   

methyl 2,7-dimethoxy-9h-carbazole-3-carboxylate

methyl 2,7-dimethoxy-9h-carbazole-3-carboxylate

C16H15NO4 (285.1001)


   

(13r)-16-methyl-13-(prop-1-en-2-yl)-3,5,14-trioxa-16-azatetracyclo[7.7.0.0²,⁶.0¹¹,¹⁵]hexadeca-1,6,8,11(15)-tetraen-10-one

(13r)-16-methyl-13-(prop-1-en-2-yl)-3,5,14-trioxa-16-azatetracyclo[7.7.0.0²,⁶.0¹¹,¹⁵]hexadeca-1,6,8,11(15)-tetraen-10-one

C16H15NO4 (285.1001)


   

(2r,3r)-2-hydroxy-3-(4-methoxyphenyl)-1,2-dihydroindole-3-carboxylic acid

(2r,3r)-2-hydroxy-3-(4-methoxyphenyl)-1,2-dihydroindole-3-carboxylic acid

C16H15NO4 (285.1001)


   

3-methoxy-4-phenyl-3h-quinoline-2,4,6-triol

3-methoxy-4-phenyl-3h-quinoline-2,4,6-triol

C16H15NO4 (285.1001)


   

4a,n-dedihydronoraugustamine

NA

C16H15NO4 (285.1001)


{"Ingredient_id": "HBIN010220","Ingredient_name": "4a,n-dedihydronoraugustamine","Alias": "NA","Ingredient_formula": "C16H15NO4","Ingredient_Smile": "C1CC2=NCCC23C4C1OC(O4)C5=CC6=C(C=C35)OCO6","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "4865","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   

11,16,18-trioxa-4-azapentacyclo[11.7.0.0²,¹⁰.0³,⁷.0¹⁵,¹⁹]icosa-1(20),7,13,15(19)-tetraen-12-one

11,16,18-trioxa-4-azapentacyclo[11.7.0.0²,¹⁰.0³,⁷.0¹⁵,¹⁹]icosa-1(20),7,13,15(19)-tetraen-12-one

C16H15NO4 (285.1001)


   

9-methoxy-8-oxa-17-azatetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadeca-1(17),2,4,6,10,15-hexaene-4,14-diol

9-methoxy-8-oxa-17-azatetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadeca-1(17),2,4,6,10,15-hexaene-4,14-diol

C16H15NO4 (285.1001)


   

(3s,4s)-3-methoxy-4-phenyl-3h-quinoline-2,4,5-triol

(3s,4s)-3-methoxy-4-phenyl-3h-quinoline-2,4,5-triol

C16H15NO4 (285.1001)


   

(1r,2s,3s,4s,5r,9s,11s,12s,14r)-7-imino-2-methyl-10,13,15-trioxa-6,8-diazapentacyclo[7.4.1.1³,¹².0⁵,¹¹.0⁵,¹⁴]pentadecane-2,4,12-triol

(1r,2s,3s,4s,5r,9s,11s,12s,14r)-7-imino-2-methyl-10,13,15-trioxa-6,8-diazapentacyclo[7.4.1.1³,¹².0⁵,¹¹.0⁵,¹⁴]pentadecane-2,4,12-triol

C11H15N3O6 (285.0961)


   

1,2,3-trimethoxy-10h-acridin-9-one

1,2,3-trimethoxy-10h-acridin-9-one

C16H15NO4 (285.1001)


   

2-({[(5r)-5-hydroxy-2,5-dimethyl-4,6-dioxocyclohex-2-en-1-ylidene]amino}methyl)benzaldehyde

2-({[(5r)-5-hydroxy-2,5-dimethyl-4,6-dioxocyclohex-2-en-1-ylidene]amino}methyl)benzaldehyde

C16H15NO4 (285.1001)


   

(1r,11s,18r,19s)-5,7,20,21-tetraoxa-14-azahexacyclo[16.2.1.0²,¹⁰.0⁴,⁸.0¹¹,¹⁵.0¹¹,¹⁹]henicosa-2(10),3,8,14-tetraene

(1r,11s,18r,19s)-5,7,20,21-tetraoxa-14-azahexacyclo[16.2.1.0²,¹⁰.0⁴,⁸.0¹¹,¹⁵.0¹¹,¹⁹]henicosa-2(10),3,8,14-tetraene

C16H15NO4 (285.1001)


   

3,13,21-triazapentacyclo[11.8.0.0²,¹⁰.0⁴,⁹.0¹⁵,²⁰]henicosa-1(21),2(10),4(9),5,7,11,15,17,19-nonaen-14-one

3,13,21-triazapentacyclo[11.8.0.0²,¹⁰.0⁴,⁹.0¹⁵,²⁰]henicosa-1(21),2(10),4(9),5,7,11,15,17,19-nonaen-14-one

C18H11N3O (285.0902)


   

(3s,4s)-3-methoxy-4-phenyl-3h-quinoline-2,4,6-triol

(3s,4s)-3-methoxy-4-phenyl-3h-quinoline-2,4,6-triol

C16H15NO4 (285.1001)


   

3-methoxy-4-phenyl-3h-quinoline-2,4,5-triol

3-methoxy-4-phenyl-3h-quinoline-2,4,5-triol

C16H15NO4 (285.1001)


   

(2s)-2-amino-4-(3,4-dihydroxy-5-methoxybenzoyloxy)butanoic acid

(2s)-2-amino-4-(3,4-dihydroxy-5-methoxybenzoyloxy)butanoic acid

C12H15NO7 (285.0848)


   

n-{2-[6-(hydroxymethyl)-2h-1,3-benzodioxol-5-yl]phenyl}-n-methylformamide

n-{2-[6-(hydroxymethyl)-2h-1,3-benzodioxol-5-yl]phenyl}-n-methylformamide

C16H15NO4 (285.1001)


   

3,4-dimethoxy-5-methylbenzo[h]quinoline-2,7-diol

3,4-dimethoxy-5-methylbenzo[h]quinoline-2,7-diol

C16H15NO4 (285.1001)


   

(2s,3s,10r)-11,16,18-trioxa-4-azapentacyclo[11.7.0.0²,¹⁰.0³,⁷.0¹⁵,¹⁹]icosa-1(20),7,13,15(19)-tetraen-12-one

(2s,3s,10r)-11,16,18-trioxa-4-azapentacyclo[11.7.0.0²,¹⁰.0³,⁷.0¹⁵,¹⁹]icosa-1(20),7,13,15(19)-tetraen-12-one

C16H15NO4 (285.1001)


   

3-hydroxy-1,4-dimethoxy-10-methylacridin-9-one

3-hydroxy-1,4-dimethoxy-10-methylacridin-9-one

C16H15NO4 (285.1001)


   

(3r,4s)-4-(4-methoxyphenyl)-3h-quinoline-2,3,4-triol

(3r,4s)-4-(4-methoxyphenyl)-3h-quinoline-2,3,4-triol

C16H15NO4 (285.1001)


   

4,4,9-trimethyl-3,12,14-trioxa-9-azatetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadeca-1(17),2(7),5,10,15-pentaen-8-one

4,4,9-trimethyl-3,12,14-trioxa-9-azatetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadeca-1(17),2(7),5,10,15-pentaen-8-one

C16H15NO4 (285.1001)


   

4-(4-methoxyphenyl)-3h-quinoline-2,3,4-triol

4-(4-methoxyphenyl)-3h-quinoline-2,3,4-triol

C16H15NO4 (285.1001)


   

(3s,4r)-4-(4-methoxyphenyl)-3h-quinoline-2,3,4-triol

(3s,4r)-4-(4-methoxyphenyl)-3h-quinoline-2,3,4-triol

C16H15NO4 (285.1001)


   

3,11,21-triazapentacyclo[11.8.0.0²,¹¹.0⁴,⁹.0¹⁵,²⁰]henicosa-1(21),2,4,6,8,13,15,17,19-nonaen-10-one

3,11,21-triazapentacyclo[11.8.0.0²,¹¹.0⁴,⁹.0¹⁵,²⁰]henicosa-1(21),2,4,6,8,13,15,17,19-nonaen-10-one

C18H11N3O (285.0902)


   

4-hydroxy-3,6-dimethoxy-2-methyl-9h-carbazole-1-carbaldehyde

4-hydroxy-3,6-dimethoxy-2-methyl-9h-carbazole-1-carbaldehyde

C16H15NO4 (285.1001)


   

16-methyl-13-(prop-1-en-2-yl)-3,5,14-trioxa-16-azatetracyclo[7.7.0.0²,⁶.0¹¹,¹⁵]hexadeca-1,6,8,11(15)-tetraen-10-one

16-methyl-13-(prop-1-en-2-yl)-3,5,14-trioxa-16-azatetracyclo[7.7.0.0²,⁶.0¹¹,¹⁵]hexadeca-1,6,8,11(15)-tetraen-10-one

C16H15NO4 (285.1001)


   

3-hydroxy-1,2-dimethoxy-10-methylacridin-9-one

3-hydroxy-1,2-dimethoxy-10-methylacridin-9-one

C16H15NO4 (285.1001)


   

4-hydroxy-3-(3-hydroxy-3-methylindol-2-yl)-5,6-dimethylpyran-2-one

4-hydroxy-3-(3-hydroxy-3-methylindol-2-yl)-5,6-dimethylpyran-2-one

C16H15NO4 (285.1001)


   

(3s)-3-hydroxy-3-[(2-hydroxy-4,5-dimethoxyphenyl)-c-hydroxycarbonimidoyl]propanoic acid

(3s)-3-hydroxy-3-[(2-hydroxy-4,5-dimethoxyphenyl)-c-hydroxycarbonimidoyl]propanoic acid

C12H15NO7 (285.0848)


   

(3s,4s)-4-(4-methoxyphenyl)-3h-quinoline-2,3,4-triol

(3s,4s)-4-(4-methoxyphenyl)-3h-quinoline-2,3,4-triol

C16H15NO4 (285.1001)


   

(3r,4r)-4-(4-methoxyphenyl)-3h-quinoline-2,3,4-triol

(3r,4r)-4-(4-methoxyphenyl)-3h-quinoline-2,3,4-triol

C16H15NO4 (285.1001)


   

3-hydroxy-3-[(2-hydroxy-4,5-dimethoxyphenyl)-c-hydroxycarbonimidoyl]propanoic acid

3-hydroxy-3-[(2-hydroxy-4,5-dimethoxyphenyl)-c-hydroxycarbonimidoyl]propanoic acid

C12H15NO7 (285.0848)


   

5,7,20,21-tetraoxa-14-azahexacyclo[16.2.1.0²,¹⁰.0⁴,⁸.0¹¹,¹⁵.0¹¹,¹⁹]henicosa-2(10),3,8,14-tetraene

5,7,20,21-tetraoxa-14-azahexacyclo[16.2.1.0²,¹⁰.0⁴,⁸.0¹¹,¹⁵.0¹¹,¹⁹]henicosa-2(10),3,8,14-tetraene

C16H15NO4 (285.1001)


   

2-amino-4-(3,4-dihydroxy-5-methoxybenzoyloxy)butanoic acid

2-amino-4-(3,4-dihydroxy-5-methoxybenzoyloxy)butanoic acid

C12H15NO7 (285.0848)