Exact Mass: 339.1178782

Exact Mass Matches: 339.1178782

Found 173 metabolites which its exact mass value is equals to given mass value 339.1178782, within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error 0.001 dalton.

Phenoxybenzamine HCl

Phenoxybenzamine hydrochloride

C18H23Cl2NO (339.1156608)


C78272 - Agent Affecting Nervous System > C29747 - Adrenergic Agent > C72900 - Adrenergic Antagonist D018377 - Neurotransmitter Agents > D018663 - Adrenergic Agents > D018674 - Adrenergic Antagonists D002317 - Cardiovascular Agents > D000959 - Antihypertensive Agents D002317 - Cardiovascular Agents > D014665 - Vasodilator Agents Phenoxybenzamine hydrochloride is a nonselective, irreversible, orally active α-adrenoceptor antagonist that is commonly used for the research of hypertension, specifically caused by pheochromocytoma. Phenoxybenzamine hydrochloride also shows antitumor activity[1][2].

   

Moguisteine

Moguisteine

C16H21NO5S (339.1140376)


C78273 - Agent Affecting Respiratory System > C74536 - Mucolytic Agent

   

1-Hydroxyrutacridone epoxide

1,5-dihydroxy-11-methyl-2-(2-methyloxiran-2-yl)-1H,2H,6H,11H-furo[2,3-c]acridin-6-one

C19H17NO5 (339.1106672)


1-Hydroxyrutacridone epoxide is an alkaloid from the callus tissue of Ruta graveolens (rue). Alkaloid from the callus tissue of Ruta graveolens (rue).

   

Rutagravine

6,11-dihydroxy-6,20-dimethyl-4,8-dioxa-20-azapentacyclo[10.8.0.0²,⁹.0³,⁷.0¹⁴,¹⁹]icosa-1(12),2(9),10,14,16,18-hexaen-13-one

C19H17NO5 (339.1106672)


Rutagravine is found in herbs and spices. Rutagravine is an alkaloid from the callus tissue of Ruta graveolens (rue). Alkaloid from the callus tissue of Ruta graveolens (rue). Rutagravine is found in herbs and spices.

   

7-Hydroxygliclazide

N-{5-hydroxy-octahydrocyclopenta[c]pyrrol-2-yl}-N-(4-methylbenzenesulphonyl)carbamimidic acid

C15H21N3O4S (339.1252706)


7-Hydroxygliclazide is only found in individuals that have used or taken Gliclazide. 7-Hydroxygliclazide is a metabolite of Gliclazide. 7-hydroxygliclazide belongs to the family of Benzenesulfonamides. These are organic compounds containing a sulfonamide group that is S-linked to a benzene ring.

   

6-Hydroxygliclazide

N-{4-hydroxy-octahydrocyclopenta[c]pyrrol-2-yl}-N-(4-methylbenzenesulphonyl)carbamimidic acid

C15H21N3O4S (339.1252706)


6-Hydroxygliclazide is only found in individuals that have used or taken Gliclazide. 6-Hydroxygliclazide is a metabolite of Gliclazide. 6-hydroxygliclazide belongs to the family of Benzenesulfonamides. These are organic compounds containing a sulfonamide group that is S-linked to a benzene ring.

   

Methylhydroxygliclazide

N-[4-(Hydroxymethyl)benzenesulphonyl]-n-{octahydrocyclopenta[c]pyrrol-2-yl}carbamimidic acid

C15H21N3O4S (339.1252706)


Methylhydroxygliclazide is only found in individuals that have used or taken Gliclazide. Methylhydroxygliclazide is a metabolite of Gliclazide. Methylhydroxygliclazide belongs to the family of Benzenesulfonamides. These are organic compounds containing a sulfonamide group that is S-linked to a benzene ring.

   

20-Hydroxyrutacridone epoxide

5-hydroxy-2-[2-(hydroxymethyl)oxiran-2-yl]-11-methyl-1H,2H,6H,11H-furo[2,3-c]acridin-6-one

C19H17NO5 (339.1106672)


20-Hydroxyrutacridone epoxide is found in herbs and spices. 20-Hydroxyrutacridone epoxide is an alkaloid from the roots and callus tissue cultures of Ruta graveolens (rue). Alkaloid from the roots and callus tissue cultures of Ruta graveolens (rue). 20-Hydroxyrutacridone epoxide is found in herbs and spices.

   

n2-(1-Carboxyethyl)-2'-deoxyguanosine

2-({6-hydroxy-9-[4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-3,9-dihydro-2H-purin-2-ylidene}amino)propanoate

C13H17N5O6 (339.1178782)


   

Loxoribine

2-amino-9-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-7-(prop-2-en-1-yl)-6,7,8,9-tetrahydro-1H-purine-6,8-dione

C13H17N5O6 (339.1178782)


   

Moguisteine

Ethyl 3-{2-[(2-methoxyphenoxy)methyl]-1,3-thiazolidin-3-yl}-3-oxopropanoic acid

C16H21NO5S (339.1140376)


   

Panipenem

3-[(1-ethanimidoylpyrrolidin-3-yl)sulfanyl]-6-(1-hydroxyethyl)-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid

C15H21N3O4S (339.1252706)


   

Tox21_302226

BENZENEACETIC ACID, ALPHA-(HYDROXYMETHYL)-, 9-METHYL-3-OXA-9-AZATRICYCLO(3.3.1.0(SUP 2,4))NON-7-YL ESTER, HYDROCHLORIDE, (7(S)-(1-.ALPHA.,2-.BETA.,4-.BETA.,5-.ALPHA.,7-.BETA.))-

C17H21NO4.HCl (339.1237282)


   
   
   
   
   

8-Oxotetrahydrothalifendine

8-Oxotetrahydrothalifendine

C19H17NO5 (339.1106672)


   
   
   

12-Hydroxycrychine

(-)-12-Hydroxycrychine

C19H17NO5 (339.1106672)


   
   
   

(-)-13-beta-Hydroxystylopine

(-)-13-beta-Hydroxystylopine

C19H17NO5 (339.1106672)


   
   
   
   

O=C(OC)CCCN1C(=O)c2c(-c3c1cccc3)cc1OCOc1c2

O=C(OC)CCCN1C(=O)c2c(-c3c1cccc3)cc1OCOc1c2

C19H17NO5 (339.1106672)


   
   

(14R)-Reframidine N-oxide

(14R)-Reframidine N-oxide

C19H17NO5 (339.1106672)


   
   
   
   

[[1-amino-3-(5-methyl-2-oxo-1,3-benzoxazol-3-yl)propylidene]amino] benzoate

[[1-amino-3-(5-methyl-2-oxo-1,3-benzoxazol-3-yl)propylidene]amino] benzoate

C18H17N3O4 (339.1219002)


   
   
   
   
   
   

(+)-N-formylhernangerine

(+)-N-formylhernangerine

C19H17NO5 (339.1106672)


   
   
   

aristololactam CIII

aristololactam CIII

C19H17NO5 (339.1106672)


   

5-hydroxynoracronycine alcohol

5-hydroxynoracronycine alcohol

C19H17NO5 (339.1106672)


   
   

desulfo-5-methylsulfanylpentyl GL|desulfoglucoberteroin|DS-GBE

desulfo-5-methylsulfanylpentyl GL|desulfoglucoberteroin|DS-GBE

C13H25NO5S2 (339.117408)


   

(+)-11-methoxynornoelistine

(+)-11-methoxynornoelistine

C19H17NO5 (339.1106672)


   

N-Ethoxycarbonylethylcrinasiadine

N-Ethoxycarbonylethylcrinasiadine

C19H17NO5 (339.1106672)


   

5,6-dihydro-3,10-dihydroxy-9,11-dimethoxy-8H-dibenzo[a,g]quinolizine-8-one|pendulamine B

5,6-dihydro-3,10-dihydroxy-9,11-dimethoxy-8H-dibenzo[a,g]quinolizine-8-one|pendulamine B

C19H17NO5 (339.1106672)


   

2-(7-Methoxy-1,3-benzodioxol-5-yl)-8-methoxy-1-methylquinolin-4(1H)-one

2-(7-Methoxy-1,3-benzodioxol-5-yl)-8-methoxy-1-methylquinolin-4(1H)-one

C19H17NO5 (339.1106672)


   
   

3-(1,1-Dimethoxy-2-oxoethoxy)-9,10-dihydro-1-methoxy-9-oxo-4-acridinecarboxaldehyde

3-(1,1-Dimethoxy-2-oxoethoxy)-9,10-dihydro-1-methoxy-9-oxo-4-acridinecarboxaldehyde

C19H17NO5 (339.1106672)


   
   
   
   

Tox21_302226

BENZENEACETIC ACID, ALPHA-(HYDROXYMETHYL)-, 9-METHYL-3-OXA-9-AZATRICYCLO(3.3.1.0(SUP 2,4))NON-7-YL ESTER, HYDROCHLORIDE, (7(S)-(1-.ALPHA.,2-.BETA.,4-.BETA.,5-.ALPHA.,7-.BETA.))-

C17H22ClNO4 (339.1237282000001)


   
   

N2-S-Carboxyethyl-deoxyguanosine

N2-S-Carboxyethyl-deoxyguanosine

C13H17N5O6 (339.1178782)


   
   
   
   
   
   
   

N-[[(hexahydrocyclopenta[c]pyrrol-2(1H)-yl)amino]carbonyl]-4-(hydroxymethyl)-Benzenesulfonamide

N-[[(hexahydrocyclopenta[c]pyrrol-2(1H)-yl)amino]carbonyl]-4-(hydroxymethyl)-Benzenesulfonamide

C15H21N3O4S (339.1252706)


   

N-((4-hydroxyhexahydrocyclopenta[c]pyrrol-2(1H)-yl)carbamoyl)-4-methylbenzenesulfonamide

N-((4-hydroxyhexahydrocyclopenta[c]pyrrol-2(1H)-yl)carbamoyl)-4-methylbenzenesulfonamide

C15H21N3O4S (339.1252706)


   

N-((5-hydroxyhexahydrocyclopenta[c]pyrrol-2(1H)-yl)carbamoyl)-4-methylbenzenesulfonamide

N-((5-hydroxyhexahydrocyclopenta[c]pyrrol-2(1H)-yl)carbamoyl)-4-methylbenzenesulfonamide

C15H21N3O4S (339.1252706)


   
   

Rutagravine

6,11-dihydroxy-6,20-dimethyl-4,8-dioxa-20-azapentacyclo[10.8.0.0^{2,9}.0^{3,7}.0^{14,19}]icosa-1,9,11,14,16,18-hexaen-13-one

C19H17NO5 (339.1106672)


   

1-Hydroxyrutacridone epoxide

1,5-dihydroxy-11-methyl-2-(2-methyloxiran-2-yl)-1H,2H,6H,11H-furo[2,3-c]acridin-6-one

C19H17NO5 (339.1106672)


   

20-Hydroxyrutacridone epoxide

5-hydroxy-2-[2-(hydroxymethyl)oxiran-2-yl]-11-methyl-1H,2H,6H,11H-furo[2,3-c]acridin-6-one

C19H17NO5 (339.1106672)


   

Mofezolac

Mofezolac

C19H17NO5 (339.1106672)


D018501 - Antirheumatic Agents > D000894 - Anti-Inflammatory Agents, Non-Steroidal > D016861 - Cyclooxygenase Inhibitors 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 D004791 - Enzyme Inhibitors

   

N-BOC-4-(P-CHLOROPHENYL)-4-PIPERIDINE CARBOXYLIC ACID

N-BOC-4-(P-CHLOROPHENYL)-4-PIPERIDINE CARBOXYLIC ACID

C17H22ClNO4 (339.1237282000001)


   

1-benzyl-3-methyl 6-methoxyindole-1,3-dicarboxylate

1-benzyl-3-methyl 6-methoxyindole-1,3-dicarboxylate

C19H17NO5 (339.1106672)


   

(S)-N-DESISOPROPYLPROPRANOLOL

(S)-N-DESISOPROPYLPROPRANOLOL

C19H17NO5 (339.1106672)


   
   
   

cocaine Hcl

Cocaine hydrochloride

C17H22ClNO4 (339.1237282000001)


D018377 - Neurotransmitter Agents > D014179 - Neurotransmitter Uptake Inhibitors > D018765 - Dopamine Uptake Inhibitors D002491 - Central Nervous System Agents > D002492 - Central Nervous System Depressants > D000777 - Anesthetics D018373 - Peripheral Nervous System Agents > D018689 - Sensory System Agents D002317 - Cardiovascular Agents > D014662 - Vasoconstrictor Agents C78272 - Agent Affecting Nervous System > C47795 - CNS Stimulant D018377 - Neurotransmitter Agents > D015259 - Dopamine Agents D049990 - Membrane Transport Modulators

   

Panipenem

Panipenem

C15H21N3O4S (339.1252706)


D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D013845 - Thienamycins D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D047090 - beta-Lactams D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D007769 - Lactams C254 - Anti-Infective Agent > C258 - Antibiotic > C260 - Beta-Lactam Antibiotic

   
   

(2S,4R)-1-(tert-Butoxycarbonyl)-4-(2-chlorobenzyl)pyrrolidine-2-carboxylic acid

(2S,4R)-1-(tert-Butoxycarbonyl)-4-(2-chlorobenzyl)pyrrolidine-2-carboxylic acid

C17H22ClNO4 (339.1237282000001)


   

Cyprazepam

7-chloro-N-(cyclopropylmethyl)-4-hydroxy-5-phenyl-3H-1,4-benzodiazepin-2-imine

C19H18ClN3O (339.1138328)


C78272 - Agent Affecting Nervous System > C29756 - Sedative and Hypnotic > C1012 - Benzodiazepine C78272 - Agent Affecting Nervous System > C28197 - Antianxiety Agent

   

3-(3-(4-(2-METHOXYETHOXY)PHENYL)ISOXAZOL-5-YL)BENZOIC ACID

3-(3-(4-(2-METHOXYETHOXY)PHENYL)ISOXAZOL-5-YL)BENZOIC ACID

C19H17NO5 (339.1106672)


   

(R)-3-((BENZYLOXY)AMINO)-4-(2,4,5-TRIFLUOROPHENYL)BUTANOIC ACID

(R)-3-((BENZYLOXY)AMINO)-4-(2,4,5-TRIFLUOROPHENYL)BUTANOIC ACID

C17H16F3NO3 (339.1082222)


   

Loxoribine

Loxoribine

C13H17N5O6 (339.1178782)


C308 - Immunotherapeutic Agent > C210 - Immunoadjuvant > C2554 - Vaccine Adjuvant C2140 - Adjuvant Loxoribine (7-Allyl-8-oxoguanosine) is a guanosine analog with anti-viral and anti-tumor activities. Loxoribine is an orally bioavailable and selective Toll-like receptor (TLR) 7 agonist[1][2][3].

   

2-Butyl-3-(4-hydroxybenzoyl)-5-nitrobenzofuran

2-Butyl-3-(4-hydroxybenzoyl)-5-nitrobenzofuran

C19H17NO5 (339.1106672)


   

1H-Benz[de]isoquinoline-1,3(2H)-dione,5-nitro-2-[2-(1-pyrrolidinyl)ethyl]-

1H-Benz[de]isoquinoline-1,3(2H)-dione,5-nitro-2-[2-(1-pyrrolidinyl)ethyl]-

C18H17N3O4 (339.1219002)


   

2-[3-(1,3-DIOXO-1,3-DIHYDRO-ISOINDOL-2-YL)-PROPOXY]-BENZOIC ACID METHYL ESTER

2-[3-(1,3-DIOXO-1,3-DIHYDRO-ISOINDOL-2-YL)-PROPOXY]-BENZOIC ACID METHYL ESTER

C19H17NO5 (339.1106672)


   

1-(2,3-Dihydro-1,4-benzodioxin-3-ylmethyl)-5-ethoxyindole-2,3-dione

1-(2,3-Dihydro-1,4-benzodioxin-3-ylmethyl)-5-ethoxyindole-2,3-dione

C19H17NO5 (339.1106672)


   

n2-(1-Carboxyethyl)-2-deoxyguanosine

n2-(1-Carboxyethyl)-2-deoxyguanosine

C13H17N5O6 (339.1178782)


   

Benzoic acid [[1-(4-nitrophenyl)-4-piperidinylidene]amino] ester

Benzoic acid [[1-(4-nitrophenyl)-4-piperidinylidene]amino] ester

C18H17N3O4 (339.1219002)


   

8-[(1-ethyl-3-piperidinyl)thio]-1,3-dimethyl-6-sulfanylidene-7H-purin-2-one

8-[(1-ethyl-3-piperidinyl)thio]-1,3-dimethyl-6-sulfanylidene-7H-purin-2-one

C14H21N5OS2 (339.1187456)


   

3-[[2-(6-Methoxy-3-benzofuranyl)-1-oxoethyl]amino]benzoic acid methyl ester

3-[[2-(6-Methoxy-3-benzofuranyl)-1-oxoethyl]amino]benzoic acid methyl ester

C19H17NO5 (339.1106672)


   

3-[[(3-Methoxyphenyl)-oxomethyl]amino]-2-benzofurancarboxylic acid ethyl ester

3-[[(3-Methoxyphenyl)-oxomethyl]amino]-2-benzofurancarboxylic acid ethyl ester

C19H17NO5 (339.1106672)


   

N(2)-(S)-carboxyethyl-2-deoxyguanosine

N(2)-(S)-carboxyethyl-2-deoxyguanosine

C13H17N5O6 (339.1178782)


   

N(2)-(R)-carboxyethyl-2-deoxyguanosine

N(2)-(R)-carboxyethyl-2-deoxyguanosine

C13H17N5O6 (339.1178782)


   

3-(Hydroxy-phenyl-phosphinoyloxy)-8-methyl-8-aza-bicyclo[3.2.1]octane-2-carboxylic acid methyl ester

3-(Hydroxy-phenyl-phosphinoyloxy)-8-methyl-8-aza-bicyclo[3.2.1]octane-2-carboxylic acid methyl ester

C16H22NO5P (339.1235532)


   

(2r,3r,4r,5r)-4,5-Dihydroxy-2-(Hydroxymethyl)-6-Oxopiperidin-3-Yl Beta-D-Glucopyranoside

(2r,3r,4r,5r)-4,5-Dihydroxy-2-(Hydroxymethyl)-6-Oxopiperidin-3-Yl Beta-D-Glucopyranoside

C12H21NO10 (339.1165406)


   

Panipenem

3-[(1-ethanimidoylpyrrolidin-3-yl)sulfanyl]-6-(1-hydroxyethyl)-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid

C15H21N3O4S (339.1252706)


   

3,5-dihydroxy-2-[(2E)-3-(4-hydroxyphenyl)prop-2-enoyl]-6-(3-methylbut-2-en-1-yl)phenolate

3,5-dihydroxy-2-[(2E)-3-(4-hydroxyphenyl)prop-2-enoyl]-6-(3-methylbut-2-en-1-yl)phenolate

C20H19O5- (339.12324240000004)


   

7-Hydroxy-2-(4-hydroxyphenyl)-6-(3-methylbut-2-enyl)-4-oxo-2,3-dihydrochromen-5-olate

7-Hydroxy-2-(4-hydroxyphenyl)-6-(3-methylbut-2-enyl)-4-oxo-2,3-dihydrochromen-5-olate

C20H19O5- (339.12324240000004)


   

2-[1-[(4-Amino-2-methylpyrimidin-5-yl)methyl]-2-methylpyridin-1-ium-3-yl]ethyl dihydrogen phosphate

2-[1-[(4-Amino-2-methylpyrimidin-5-yl)methyl]-2-methylpyridin-1-ium-3-yl]ethyl dihydrogen phosphate

C14H20N4O4P+ (339.12221100000005)


   

2-amino-9-[3,4-dihydroxy-5-(hydroxymethyl)-2-oxolanyl]-7-prop-2-enyl-3H-purine-6,8-dione

2-amino-9-[3,4-dihydroxy-5-(hydroxymethyl)-2-oxolanyl]-7-prop-2-enyl-3H-purine-6,8-dione

C13H17N5O6 (339.1178782)


   

2-[[9-[4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-6-oxo-1H-purin-2-yl]amino]propanoic acid

2-[[9-[4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-6-oxo-1H-purin-2-yl]amino]propanoic acid

C13H17N5O6 (339.1178782)


   

N-(4-chlorophenyl)-5-methyl-2-[(4-methylphenyl)methyl]-3-pyrazolecarboxamide

N-(4-chlorophenyl)-5-methyl-2-[(4-methylphenyl)methyl]-3-pyrazolecarboxamide

C19H18ClN3O (339.1138328)


   

sophoraflavanone B(1-)

sophoraflavanone B(1-)

C20H19O5- (339.12324240000004)


Conjugate base of sophoraflavanone B arising from deprotonation of the 7-hydroxy group.

   

3-(Dimethylamino)benzoic acid (7-hydroxy-2-oxo-1-benzopyran-4-yl)methyl ester

3-(Dimethylamino)benzoic acid (7-hydroxy-2-oxo-1-benzopyran-4-yl)methyl ester

C19H17NO5 (339.1106672)


   

2-[[4-(2,4-Dimethylphenyl)-5-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]acetamide

2-[[4-(2,4-Dimethylphenyl)-5-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]acetamide

C17H17N5OS (339.1153752)


   

4-[4-(3-Methoxyphenyl)-6-(trifluoromethyl)-2-pyrimidinyl]morpholine

4-[4-(3-Methoxyphenyl)-6-(trifluoromethyl)-2-pyrimidinyl]morpholine

C16H16F3N3O2 (339.1194552)


   

N-(5-methyl-7-phenyl-1,5,6,7-tetrahydro-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-2-thiophenecarboxamide

N-(5-methyl-7-phenyl-1,5,6,7-tetrahydro-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-2-thiophenecarboxamide

C17H17N5OS (339.1153752)


   

1-(3-Chloro-4-fluorophenyl)-4-[(4-methyl-1-piperazinyl)-oxomethyl]-2-pyrrolidinone

1-(3-Chloro-4-fluorophenyl)-4-[(4-methyl-1-piperazinyl)-oxomethyl]-2-pyrrolidinone

C16H19ClFN3O2 (339.1149756)


   

(1R,2R,3S,5S)-3-(benzoyloxy)-2-(methoxycarbonyl)-8-methyl-8-azoniabicyclo[3.2.1]octane chloride

(1R,2R,3S,5S)-3-(benzoyloxy)-2-(methoxycarbonyl)-8-methyl-8-azoniabicyclo[3.2.1]octane chloride

C17H22ClNO4 (339.1237282000001)


   

3-(Phenoxymethyl)-2-benzofurancarboxylic acid (1-amino-1-oxopropan-2-yl) ester

3-(Phenoxymethyl)-2-benzofurancarboxylic acid (1-amino-1-oxopropan-2-yl) ester

C19H17NO5 (339.1106672)


   

N-(3,4-dimethylphenyl)-2-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)thio]acetamide

N-(3,4-dimethylphenyl)-2-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)thio]acetamide

C17H17N5OS (339.1153752)


   

2-[1-[(2-chloro-6-fluorophenyl)methyl]-3-oxo-2-piperazinyl]-N-prop-2-enylacetamide

2-[1-[(2-chloro-6-fluorophenyl)methyl]-3-oxo-2-piperazinyl]-N-prop-2-enylacetamide

C16H19ClFN3O2 (339.1149756)


   

N-[(E)-1-(3-Acetamidophenyl)ethylideneamino]-1,3-benzodioxole-5-carboxamide

N-[(E)-1-(3-Acetamidophenyl)ethylideneamino]-1,3-benzodioxole-5-carboxamide

C18H17N3O4 (339.1219002)


   
   
   
   
   
   
   

1-[(1S,2S)-2-[(3-chlorophenyl)methoxy]-1,2,3,4-tetrahydronaphthalen-1-yl]triazole

1-[(1S,2S)-2-[(3-chlorophenyl)methoxy]-1,2,3,4-tetrahydronaphthalen-1-yl]triazole

C19H18ClN3O (339.1138328)


   

desmethylxanthohumol(1-)

desmethylxanthohumol(1-)

C20H19O5 (339.12324240000004)


A phenolate anion that is the conjugate base of xanthohumol, obtained by deprotonation of the 1-hydroxy group. It is the major microspecies at pH 7.3 (according to Marvin v 6.2.0.).

   

Methylhydroxygliclazide

Methylhydroxygliclazide

C15H21N3O4S (339.1252706)


   
   

O-hydroxy(phenyl)phosphinoyl ecgonine methyl ester

O-hydroxy(phenyl)phosphinoyl ecgonine methyl ester

C16H22NO5P (339.1235532)


The O-hydroxy(phenyl)phosphinoyl derivative of ecgonine methyl ester.

   

VU6010572

VU6010572

C20H18FNO3 (339.127065)


VU6010572 is a potent and selective mGlu3 negative allosteric modulator with IC50 of 245 nM. VU6010572 is highly CNS penetrant[1][2].

   

3,10-dihydroxy-2,4-dimethoxy-7,8-dihydro-6-azatetraphen-5-one

3,10-dihydroxy-2,4-dimethoxy-7,8-dihydro-6-azatetraphen-5-one

C19H17NO5 (339.1106672)


   

(1r,12s)-23-methyl-5,7,16,18-tetraoxa-23-azahexacyclo[10.10.1.0²,¹⁰.0⁴,⁸.0¹³,²¹.0¹⁵,¹⁹]tricosa-2,4(8),9,13,15(19),20-hexaen-1-ol

(1r,12s)-23-methyl-5,7,16,18-tetraoxa-23-azahexacyclo[10.10.1.0²,¹⁰.0⁴,⁸.0¹³,²¹.0¹⁵,¹⁹]tricosa-2,4(8),9,13,15(19),20-hexaen-1-ol

C19H17NO5 (339.1106672)


   

(1r,24r)-5,7,17,19-tetraoxa-13-azahexacyclo[11.11.0.0²,¹⁰.0⁴,⁸.0¹⁵,²³.0¹⁶,²⁰]tetracosa-2,4(8),9,15,20,22-hexaen-24-ol

(1r,24r)-5,7,17,19-tetraoxa-13-azahexacyclo[11.11.0.0²,¹⁰.0⁴,⁸.0¹⁵,²³.0¹⁶,²⁰]tetracosa-2,4(8),9,15,20,22-hexaen-24-ol

C19H17NO5 (339.1106672)


   

17-hydroxy-16-methoxy-5,7-dioxa-13-azapentacyclo[11.8.0.0²,¹⁰.0⁴,⁸.0¹⁵,²⁰]henicosa-2,4(8),9,15(20),16,18-hexaen-14-one

17-hydroxy-16-methoxy-5,7-dioxa-13-azapentacyclo[11.8.0.0²,¹⁰.0⁴,⁸.0¹⁵,²⁰]henicosa-2,4(8),9,15(20),16,18-hexaen-14-one

C19H17NO5 (339.1106672)


   

6,7,11-trihydroxy-2,2,5-trimethyl-1-oxa-5-azatetraphen-10-one

6,7,11-trihydroxy-2,2,5-trimethyl-1-oxa-5-azatetraphen-10-one

C19H17NO5 (339.1106672)


   

23-methyl-5,7,16,18-tetraoxa-23-azahexacyclo[10.10.1.0²,¹⁰.0⁴,⁸.0¹³,²¹.0¹⁵,¹⁹]tricosa-2,4(8),9,13,15(19),20-hexaen-1-ol

23-methyl-5,7,16,18-tetraoxa-23-azahexacyclo[10.10.1.0²,¹⁰.0⁴,⁸.0¹³,²¹.0¹⁵,¹⁹]tricosa-2,4(8),9,13,15(19),20-hexaen-1-ol

C19H17NO5 (339.1106672)


   

4,5,16-trimethoxy-11-methyl-2-oxa-11-azatetracyclo[8.6.1.0³,⁸.0¹³,¹⁷]heptadeca-1(16),3,5,7,9,13(17),14-heptaen-12-one

4,5,16-trimethoxy-11-methyl-2-oxa-11-azatetracyclo[8.6.1.0³,⁸.0¹³,¹⁷]heptadeca-1(16),3,5,7,9,13(17),14-heptaen-12-one

C19H17NO5 (339.1106672)


   

6,7,8,14-tetramethoxy-2-azatetracyclo[7.6.1.0⁵,¹⁶.0¹⁰,¹⁵]hexadeca-1,3,5,7,9(16),10(15),11,13-octaen-13-ol

6,7,8,14-tetramethoxy-2-azatetracyclo[7.6.1.0⁵,¹⁶.0¹⁰,¹⁵]hexadeca-1,3,5,7,9(16),10(15),11,13-octaen-13-ol

C19H17NO5 (339.1106672)


   

(?)-12-hydroxycrychine

NA

C19H17NO5 (339.1106672)


{"Ingredient_id": "HBIN000876","Ingredient_name": "(?)-12-hydroxycrychine","Alias": "NA","Ingredient_formula": "C19H17NO5","Ingredient_Smile": "CN1C2CC3=CC4=C(C=C3C1(CC5=CC6=C(C=C25)OCO6)O)OCO4","Ingredient_weight": "339.3 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "9946","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "101148425","DrugBank_id": "NA"}

   

(—)-8-oxotetrahydrothalifendine

NA

C19H17NO5 (339.1106672)


{"Ingredient_id": "HBIN013874","Ingredient_name": "(\u2014)-8-oxotetrahydrothalifendine","Alias": "NA","Ingredient_formula": "C19H17NO5","Ingredient_Smile": "COC1=C(C=CC2=C1C(=O)N3CCC4=CC5=C(C=C4C3C2)OCO5)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "38245","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   

aristolactam c ii; 9-methoxy

NA

C19H17NO5 (339.1106672)


{"Ingredient_id": "HBIN016770","Ingredient_name": "aristolactam c ii; 9-methoxy","Alias": "NA","Ingredient_formula": "C19H17NO5","Ingredient_Smile": "NA","Ingredient_weight": "339.34","OB_score": "NA","CAS_id": "106283-32-3","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "6674","PubChem_id": "NA","DrugBank_id": "NA"}

   

6-{2h-[1,3]dioxolo[4,5-g]isoquinolin-5-ylmethyl}-2,3-dimethoxyphenol

6-{2h-[1,3]dioxolo[4,5-g]isoquinolin-5-ylmethyl}-2,3-dimethoxyphenol

C19H17NO5 (339.1106672)


   

(2r)-8-hydroxy-10,15-dimethoxy-4-methyl-5-azapentacyclo[10.5.0.0²,⁵.0⁴,⁶.0⁶,¹¹]heptadeca-1(17),7,10,12,14-pentaene-9,16-dione

(2r)-8-hydroxy-10,15-dimethoxy-4-methyl-5-azapentacyclo[10.5.0.0²,⁵.0⁴,⁶.0⁶,¹¹]heptadeca-1(17),7,10,12,14-pentaene-9,16-dione

C19H17NO5 (339.1106672)


   

(1s)-17-hydroxy-16-methoxy-5,7-dioxa-13-azapentacyclo[11.8.0.0²,¹⁰.0⁴,⁸.0¹⁵,²⁰]henicosa-2,4(8),9,15(20),16,18-hexaen-14-one

(1s)-17-hydroxy-16-methoxy-5,7-dioxa-13-azapentacyclo[11.8.0.0²,¹⁰.0⁴,⁸.0¹⁵,²⁰]henicosa-2,4(8),9,15(20),16,18-hexaen-14-one

C19H17NO5 (339.1106672)


   

(1r,12r,13s)-5,7,18,20-tetraoxa-24-azahexacyclo[11.11.0.0²,¹⁰.0⁴,⁸.0¹⁴,²².0¹⁷,²¹]tetracosa-2,4(8),9,14(22),15,17(21)-hexaen-12-ol

(1r,12r,13s)-5,7,18,20-tetraoxa-24-azahexacyclo[11.11.0.0²,¹⁰.0⁴,⁸.0¹⁴,²².0¹⁷,²¹]tetracosa-2,4(8),9,14(22),15,17(21)-hexaen-12-ol

C19H17NO5 (339.1106672)


   

(1s,12s,13r)-5,7,18,20-tetraoxa-24-azahexacyclo[11.11.0.0²,¹⁰.0⁴,⁸.0¹⁴,²².0¹⁷,²¹]tetracosa-2,4(8),9,14(22),15,17(21)-hexaen-12-ol

(1s,12s,13r)-5,7,18,20-tetraoxa-24-azahexacyclo[11.11.0.0²,¹⁰.0⁴,⁸.0¹⁴,²².0¹⁷,²¹]tetracosa-2,4(8),9,14(22),15,17(21)-hexaen-12-ol

C19H17NO5 (339.1106672)


   

5,7,18,20-tetraoxa-24-azahexacyclo[11.11.0.0²,¹⁰.0⁴,⁸.0¹⁴,²².0¹⁷,²¹]tetracosa-2,4(8),9,14(22),15,17(21)-hexaen-12-ol

5,7,18,20-tetraoxa-24-azahexacyclo[11.11.0.0²,¹⁰.0⁴,⁸.0¹⁴,²².0¹⁷,²¹]tetracosa-2,4(8),9,14(22),15,17(21)-hexaen-12-ol

C19H17NO5 (339.1106672)


   

(12s)-17-methoxy-4,6,19,21-tetraoxa-13-azahexacyclo[10.10.1.0²,¹⁰.0³,⁷.0¹⁶,²³.0¹⁸,²²]tricosa-1(23),2(10),3(7),8,16,18(22)-hexaene

(12s)-17-methoxy-4,6,19,21-tetraoxa-13-azahexacyclo[10.10.1.0²,¹⁰.0³,⁷.0¹⁶,²³.0¹⁸,²²]tricosa-1(23),2(10),3(7),8,16,18(22)-hexaene

C19H17NO5 (339.1106672)


   

17-methoxy-5,7,19,21-tetraoxa-13-azahexacyclo[10.10.1.0²,¹⁰.0⁴,⁸.0¹⁶,²³.0¹⁸,²²]tricosa-1(23),2,4(8),9,16,18(22)-hexaene

17-methoxy-5,7,19,21-tetraoxa-13-azahexacyclo[10.10.1.0²,¹⁰.0⁴,⁸.0¹⁶,²³.0¹⁸,²²]tricosa-1(23),2,4(8),9,16,18(22)-hexaene

C19H17NO5 (339.1106672)


   

(13r)-7-methoxy-13-methyl-3,5-dioxa-11-azapentacyclo[10.7.1.0²,⁶.0⁸,²⁰.0¹⁴,¹⁹]icosa-1(20),2(6),7,11,14,16,18-heptaene-13,16-diol

(13r)-7-methoxy-13-methyl-3,5-dioxa-11-azapentacyclo[10.7.1.0²,⁶.0⁸,²⁰.0¹⁴,¹⁹]icosa-1(20),2(6),7,11,14,16,18-heptaene-13,16-diol

C19H17NO5 (339.1106672)


   

4,15,16-trimethoxy-10-azatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(16),2(7),4,8,13(17),14-hexaene-3,6-dione

4,15,16-trimethoxy-10-azatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(16),2(7),4,8,13(17),14-hexaene-3,6-dione

C19H17NO5 (339.1106672)


   

6,7-dimethoxy-16,18-dioxa-10-azapentacyclo[11.7.0.0²,¹⁰.0³,⁸.0¹⁵,¹⁹]icosa-1(20),3,5,7,13,15(19)-hexaen-9-one

6,7-dimethoxy-16,18-dioxa-10-azapentacyclo[11.7.0.0²,¹⁰.0³,⁸.0¹⁵,¹⁹]icosa-1(20),3,5,7,13,15(19)-hexaen-9-one

C19H17NO5 (339.1106672)


   

8-methoxy-2-(7-methoxy-2h-1,3-benzodioxol-5-yl)-1-methylquinolin-4-one

8-methoxy-2-(7-methoxy-2h-1,3-benzodioxol-5-yl)-1-methylquinolin-4-one

C19H17NO5 (339.1106672)


   

5,7,17,19-tetraoxa-13-azahexacyclo[11.11.0.0²,¹⁰.0⁴,⁸.0¹⁵,²³.0¹⁶,²⁰]tetracosa-2,4(8),9,15,20,22-hexaen-24-ol

5,7,17,19-tetraoxa-13-azahexacyclo[11.11.0.0²,¹⁰.0⁴,⁸.0¹⁵,²³.0¹⁶,²⁰]tetracosa-2,4(8),9,15,20,22-hexaen-24-ol

C19H17NO5 (339.1106672)


   

(2r)-6,7-dimethoxy-16,18-dioxa-10-azapentacyclo[11.7.0.0²,¹⁰.0³,⁸.0¹⁵,¹⁹]icosa-1(20),3,5,7,13,15(19)-hexaen-9-one

(2r)-6,7-dimethoxy-16,18-dioxa-10-azapentacyclo[11.7.0.0²,¹⁰.0³,⁸.0¹⁵,¹⁹]icosa-1(20),3,5,7,13,15(19)-hexaen-9-one

C19H17NO5 (339.1106672)


   

16-hydroxy-4,15-dimethoxy-10-methyl-10-azatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(16),2(7),4,8,13(17),14-hexaene-3,6-dione

16-hydroxy-4,15-dimethoxy-10-methyl-10-azatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(16),2(7),4,8,13(17),14-hexaene-3,6-dione

C19H17NO5 (339.1106672)


   

6,8,14,15-tetramethoxy-10-azatetracyclo[7.6.1.0²,⁷.0¹²,¹⁶]hexadeca-1(16),2(7),3,5,8,10,12,14-octaen-11-ol

6,8,14,15-tetramethoxy-10-azatetracyclo[7.6.1.0²,⁷.0¹²,¹⁶]hexadeca-1(16),2(7),3,5,8,10,12,14-octaen-11-ol

C19H17NO5 (339.1106672)


   

(12s)-17-methoxy-5,7,19,21-tetraoxa-13-azahexacyclo[10.10.1.0²,¹⁰.0⁴,⁸.0¹⁶,²³.0¹⁸,²²]tricosa-1(23),2,4(8),9,16,18(22)-hexaene

(12s)-17-methoxy-5,7,19,21-tetraoxa-13-azahexacyclo[10.10.1.0²,¹⁰.0⁴,⁸.0¹⁶,²³.0¹⁸,²²]tricosa-1(23),2,4(8),9,16,18(22)-hexaene

C19H17NO5 (339.1106672)


   

(12s)-17-hydroxy-18-methoxy-3,5-dioxa-11-azapentacyclo[10.7.1.0²,⁶.0⁸,²⁰.0¹⁴,¹⁹]icosa-1,6,8(20),14(19),15,17-hexaene-11-carbaldehyde

(12s)-17-hydroxy-18-methoxy-3,5-dioxa-11-azapentacyclo[10.7.1.0²,⁶.0⁸,²⁰.0¹⁴,¹⁹]icosa-1,6,8(20),14(19),15,17-hexaene-11-carbaldehyde

C19H17NO5 (339.1106672)


   

methyl 7-[3-amino-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-4-hydroxy-2-imino-1h-pyrrolo[2,3-d]pyrimidine-5-carboxylate

methyl 7-[3-amino-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-4-hydroxy-2-imino-1h-pyrrolo[2,3-d]pyrimidine-5-carboxylate

C13H17N5O6 (339.1178782)


   

ethyl 3-{6-oxo-9h-[1,3]dioxolo[4,5-j]phenanthridin-5-yl}propanoate

ethyl 3-{6-oxo-9h-[1,3]dioxolo[4,5-j]phenanthridin-5-yl}propanoate

C19H17NO5 (339.1106672)


   

(1s)-16-hydroxy-17-methoxy-5,7-dioxa-13-azapentacyclo[11.8.0.0²,¹⁰.0⁴,⁸.0¹⁵,²⁰]henicosa-2,4(8),9,15,17,19-hexaen-14-one

(1s)-16-hydroxy-17-methoxy-5,7-dioxa-13-azapentacyclo[11.8.0.0²,¹⁰.0⁴,⁸.0¹⁵,²⁰]henicosa-2,4(8),9,15,17,19-hexaen-14-one

C19H17NO5 (339.1106672)


   

methyl 3-{[1-(1-hydroxyethyl)-9h-pyrido[3,4-b]indol-3-yl]formamido}prop-2-enoate

methyl 3-{[1-(1-hydroxyethyl)-9h-pyrido[3,4-b]indol-3-yl]formamido}prop-2-enoate

C18H17N3O4 (339.1219002)


   

(2s)-6,11-dihydroxy-2-(hydroxymethyl)-2,5-dimethyl-1-oxa-5-azatetraphen-10-one

(2s)-6,11-dihydroxy-2-(hydroxymethyl)-2,5-dimethyl-1-oxa-5-azatetraphen-10-one

C19H17NO5 (339.1106672)


   

6,11-dihydroxy-2-(hydroxymethyl)-2,5-dimethyl-1-oxa-5-azatetraphen-10-one

6,11-dihydroxy-2-(hydroxymethyl)-2,5-dimethyl-1-oxa-5-azatetraphen-10-one

C19H17NO5 (339.1106672)


   

3-(2h-1,3-benzodioxol-5-yl)-n-[2-(2h-1,3-benzodioxol-5-yl)ethyl]prop-2-enimidic acid

3-(2h-1,3-benzodioxol-5-yl)-n-[2-(2h-1,3-benzodioxol-5-yl)ethyl]prop-2-enimidic acid

C19H17NO5 (339.1106672)


   

(12r)-17-methoxy-5,7,19,21-tetraoxa-13-azahexacyclo[10.10.1.0²,¹⁰.0⁴,⁸.0¹⁶,²³.0¹⁸,²²]tricosa-1(23),2,4(8),9,16,18(22)-hexaene

(12r)-17-methoxy-5,7,19,21-tetraoxa-13-azahexacyclo[10.10.1.0²,¹⁰.0⁴,⁸.0¹⁶,²³.0¹⁸,²²]tricosa-1(23),2,4(8),9,16,18(22)-hexaene

C19H17NO5 (339.1106672)


   

3,11-dihydroxy-2,10-dimethoxy-7,8-dihydro-6-azatetraphen-5-one

3,11-dihydroxy-2,10-dimethoxy-7,8-dihydro-6-azatetraphen-5-one

C19H17NO5 (339.1106672)


   

methyl (2z)-3-({1-[(1r)-1-hydroxyethyl]-9h-pyrido[3,4-b]indol-3-yl}formamido)prop-2-enoate

methyl (2z)-3-({1-[(1r)-1-hydroxyethyl]-9h-pyrido[3,4-b]indol-3-yl}formamido)prop-2-enoate

C18H17N3O4 (339.1219002)


   

methyl 4-{6-oxo-9h-[1,3]dioxolo[4,5-j]phenanthridin-5-yl}butanoate

methyl 4-{6-oxo-9h-[1,3]dioxolo[4,5-j]phenanthridin-5-yl}butanoate

C19H17NO5 (339.1106672)


   

6,11-dihydroxy-6,20-dimethyl-4,8-dioxa-20-azapentacyclo[10.8.0.0²,⁹.0³,⁷.0¹⁴,¹⁹]icosa-1,9,11,14,16,18-hexaen-13-one

6,11-dihydroxy-6,20-dimethyl-4,8-dioxa-20-azapentacyclo[10.8.0.0²,⁹.0³,⁷.0¹⁴,¹⁹]icosa-1,9,11,14,16,18-hexaen-13-one

C19H17NO5 (339.1106672)


   

4,5-dimethoxy-16,18-dioxa-10-azapentacyclo[11.7.0.0²,¹⁰.0³,⁸.0¹⁵,¹⁹]icosa-1(20),3,5,7,13,15(19)-hexaen-9-one

4,5-dimethoxy-16,18-dioxa-10-azapentacyclo[11.7.0.0²,¹⁰.0³,⁸.0¹⁵,¹⁹]icosa-1(20),3,5,7,13,15(19)-hexaen-9-one

C19H17NO5 (339.1106672)


   

methyl (2z)-3-({1-[(1s)-1-hydroxyethyl]-9h-pyrido[3,4-b]indol-3-yl}formamido)prop-2-enoate

methyl (2z)-3-({1-[(1s)-1-hydroxyethyl]-9h-pyrido[3,4-b]indol-3-yl}formamido)prop-2-enoate

C18H17N3O4 (339.1219002)


   

methyl 3-({1-acetyl-9h-pyrido[3,4-b]indol-3-yl}formamido)propanoate

methyl 3-({1-acetyl-9h-pyrido[3,4-b]indol-3-yl}formamido)propanoate

C18H17N3O4 (339.1219002)


   

(2e)-3-(2h-1,3-benzodioxol-5-yl)-n-[2-(2h-1,3-benzodioxol-5-yl)ethyl]prop-2-enimidic acid

(2e)-3-(2h-1,3-benzodioxol-5-yl)-n-[2-(2h-1,3-benzodioxol-5-yl)ethyl]prop-2-enimidic acid

C19H17NO5 (339.1106672)