Exact Mass: 399.1253

Exact Mass Matches: 399.1253

Found 88 metabolites which its exact mass value is equals to given mass value 399.1253, within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error 0.001 dalton.

alanycarb

ZINC299888358

C17H25N3O4S2 (399.1286)


CONFIDENCE standard compound; EAWAG_UCHEM_ID 3033

   

Narcotoline

3-{4-hydroxy-6-methyl-2H,5H,6H,7H,8H-[1,3]dioxolo[4,5-g]isoquinolin-5-yl}-6,7-dimethoxy-1,3-dihydro-2-benzofuran-1-one

C21H21NO7 (399.1318)


Narcotoline is found in opium poppy. Narcotoline is an alkaloid from straw of Papaver somniferum (opium poppy) Narcotoline is an opiate alkaloid chemically related to noscapine. It binds to the same receptors in the brain as noscapine to act as an antitussive, and has also been used in tissue culture media. It can be obtained from the opium poppy Papaver somniferum. It is present at much higher levels in strains used for culinary purposes (poppyseed production) than in high-morphine strains used for opium production. D002492 - Central Nervous System Depressants > D009294 - Narcotics > D053610 - Opiate Alkaloids Alkaloid from straw of Papaver somniferum (opium poppy)

   

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

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

C15H21N5O6S (399.1212)


   

Niaziminin

(2S,3R,4S,5R,6S)-6-(4-{[(ethoxymethanethioyl)amino]methyl}phenoxy)-4,5-dihydroxy-2-methyloxan-3-yl acetate

C18H25NO7S (399.1352)


Niaziminin is a glucosinolate and a naturally occurring thiocarbamate. It has been isolated from the leaves of Moringa oleifera (horseradish tree). It is found in fats and oils, herbs and spices, and green vegetables. The trans and cis rotamers of niaziminin (niaziminin A and niaziminin B, respectively) differ in the orientation of the NH group with respect to sulfur. Niaziminin is the 4-O-acetyl derivative of niazimicin.

   

Adlumidiceine

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

C21H21NO7 (399.1318)


Adlumidiceine is an alkaloid from Papaver rhoeas (corn poppy). Alkaloid from Papaver rhoeas (corn poppy)

   

1H-Indole-2-carboxamide, 5-chloro-N-((1S,2R)-3-(dimethylamino)-2-hydroxy-3-oxo-1-(phenylmethyl)propyl)-

1H-Indole-2-carboxamide, 5-chloro-N-((1S,2R)-3-(dimethylamino)-2-hydroxy-3-oxo-1-(phenylmethyl)propyl)-

C21H22ClN3O3 (399.135)


   

Deferitazole

2-(2-hydroxy-3-{2-[2-(2-methoxyethoxy)ethoxy]ethoxy}phenyl)-4-methyl-4,5-dihydro-1,3-thiazole-4-carboxylic acid

C18H25NO7S (399.1352)


   

5,6,7,7a-Tetrahydro-10-hydroxy-4,11-dimethoxy-8H-benzo[g]-1,3-benzodioxolo[6,5,4-de]quinoline-7-carboxylic acid methyl ester

5,6,7,7a-Tetrahydro-10-hydroxy-4,11-dimethoxy-8H-benzo[g]-1,3-benzodioxolo[6,5,4-de]quinoline-7-carboxylic acid methyl ester

C21H21NO7 (399.1318)


   
   

6-[(R)-[6-[2-(Dimethylamino)ethyl]-1,3-benzodioxol-5-yl](hydroxy)methyl]furo[3,4-e]-1,3-benzodioxol-8(6H)-one

6-[(R)-[6-[2-(Dimethylamino)ethyl]-1,3-benzodioxol-5-yl](hydroxy)methyl]furo[3,4-e]-1,3-benzodioxol-8(6H)-one

C21H21NO7 (399.1318)


   
   

(+-)-Prepseudopalmanine|8,13-dioxo-13a-hydroxy-2,3,10,11-tetramethoxyberbine|prepseudopalmanine

(+-)-Prepseudopalmanine|8,13-dioxo-13a-hydroxy-2,3,10,11-tetramethoxyberbine|prepseudopalmanine

C21H21NO7 (399.1318)


   

4,9,10-Trimethoxy-5-(2-methylamino-aethyl)-phenanthro[3,4-d][1,3]dioxol-6,7-dion|4,9,10-trimethoxy-5-(2-methylamino-ethyl)-phenanthro[3,4-d][1,3]dioxole-6,7-dione

4,9,10-Trimethoxy-5-(2-methylamino-aethyl)-phenanthro[3,4-d][1,3]dioxol-6,7-dion|4,9,10-trimethoxy-5-(2-methylamino-ethyl)-phenanthro[3,4-d][1,3]dioxole-6,7-dione

C21H21NO7 (399.1318)


   

(??)-Palmanine|palmanine

(??)-Palmanine|palmanine

C21H21NO7 (399.1318)


   
   

deoxycylindrospermopsin

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

C15H21N5O6S (399.1212)


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)methyl groups, respectively (the 2aS,3R,4S,5aS,7R stereoisomer). A non-toxic analogue of the cyanotoxins cylindrospermopsin and 7-epi-cylindrospermopsin (the latter two have a hydroxy group attached to the carbon adjacent to the uracil ring), it is produced by several species of freshwater cyanobacteria, such as Cylindrospermopsis raciborskii.

   

Lycogarubicacid methyl ester

Lycogarubicacid methyl ester

C23H17N3O4 (399.1219)


   
   

Pesticide2_Alanycarb_C17H25N3O4S2_

Pesticide2_Alanycarb_C17H25N3O4S2_

C17H25N3O4S2 (399.1286)


   

Coralyne Chloride

coralyne chloride hydrate

C22H22ClNO4 (399.1237)


   
   
   
   
   
   

adlumidiceine

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

C21H21NO7 (399.1318)


   

6-(5-hydroxy-4-oxo-2-phenylchromen-7-yl)oxyhexyl nitrate

6-(5-hydroxy-4-oxo-2-phenylchromen-7-yl)oxyhexyl nitrate

C21H21NO7 (399.1318)


   

(s)-(+)-1-(alpha-aminobenzyl)-2-naphthol tartarate

(s)-(+)-1-(alpha-aminobenzyl)-2-naphthol tartarate

C21H21NO7 (399.1318)


   
   

Urea, N-[(2-chloro-6-methoxy-3-quinolinyl)methyl]-N-(2-methoxyethyl)-N-phenyl- (9CI)

Urea, N-[(2-chloro-6-methoxy-3-quinolinyl)methyl]-N-(2-methoxyethyl)-N-phenyl- (9CI)

C21H22ClN3O3 (399.135)


   

(R)-(-)-1-(α-aminobenzyl)-2-naphthol tartarate(salt)

(R)-(-)-1-(α-aminobenzyl)-2-naphthol tartarate(salt)

C21H21NO7 (399.1318)


   

4-(2-methylimidazole -1-yl)-2,2-diphenylbutyronitrile phosphate

4-(2-methylimidazole -1-yl)-2,2-diphenylbutyronitrile phosphate

C20H22N3O4P (399.1348)


   

H-GLU(OALL)-OALL P-TOSYLATE

H-GLU(OALL)-OALL P-TOSYLATE

C18H25NO7S (399.1352)


   

enoxastrobin

enoxastrobin

C22H22ClNO4 (399.1237)


D010575 - Pesticides > D005659 - Fungicides, Industrial > D000073739 - Strobilurins

   

4-{4-Amino-5-[(4-cyanophenyl)amino]-2-nitrophenoxy}-3,5-dimethylb enzonitrile

4-{4-Amino-5-[(4-cyanophenyl)amino]-2-nitrophenoxy}-3,5-dimethylb enzonitrile

C22H17N5O3 (399.1331)


   

(R)-(-)-mandelic acid salt of (R)-methyl 3-amino-4-(2,4,5-trifluorophenyl)butanoate

(R)-(-)-mandelic acid salt of (R)-methyl 3-amino-4-(2,4,5-trifluorophenyl)butanoate

C19H20F3NO5 (399.1294)


   

VT-464

Seviteronel

C18H17F4N3O3 (399.1206)


C147908 - Hormone Therapy Agent > C547 - Hormone Antagonist > C242 - Anti-Androgen D004791 - Enzyme Inhibitors > D065607 - Cytochrome P-450 Enzyme Inhibitors C471 - Enzyme Inhibitor > C147923 - CYP17A1 Inhibitor D000970 - Antineoplastic Agents

   

BENZYL 2-AMINO-5-(BENZYLOXY)-4-METHOXYBENZOATE HYDROCHLORIDE

BENZYL 2-AMINO-5-(BENZYLOXY)-4-METHOXYBENZOATE HYDROCHLORIDE

C22H22ClNO4 (399.1237)


   

BOC-TRANS-4-TOSYLOXY-L-PROLINE METHYL ESTER

BOC-TRANS-4-TOSYLOXY-L-PROLINE METHYL ESTER

C18H25NO7S (399.1352)


   
   

3-Furancarboxamide, 2-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]-1H-indazol-3-yl]-

3-Furancarboxamide, 2-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]-1H-indazol-3-yl]-

C21H16F3N3O2 (399.1195)


C274 - Antineoplastic Agent > C2196 - Antimetastatic Agent

   

Balcinrenone

Balcinrenone

C20H18FN3O5 (399.123)


C78274 - Agent Affecting Cardiovascular System

   

2-(2,6-Difluorophenoxy)-N-(2-fluorophenyl)-9-isopropyl-9H-purin-8-amine

2-(2,6-Difluorophenoxy)-N-(2-fluorophenyl)-9-isopropyl-9H-purin-8-amine

C20H16F3N5O (399.1307)


   
   

5-(3,4-Dimethoxyphenyl)-2-(piperidin-1-yl)-[1,3]thiazolo[4,5-b]pyridine-7-carboxylic acid

5-(3,4-Dimethoxyphenyl)-2-(piperidin-1-yl)-[1,3]thiazolo[4,5-b]pyridine-7-carboxylic acid

C20H21N3O4S (399.1253)


   

2-[[3-(2-methoxyethyl)-6-methyl-4-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]thio]-N-(2-oxolanylmethyl)acetamide

2-[[3-(2-methoxyethyl)-6-methyl-4-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]thio]-N-(2-oxolanylmethyl)acetamide

C17H25N3O4S2 (399.1286)


   

Carbonimidothioic acid, [[4-[(4-O-acetyl-6-deoxy-alpha-L-mannopyranosyl)oxy]phenyl]methyl]-, O-ethyl ester, (E)-

Carbonimidothioic acid, [[4-[(4-O-acetyl-6-deoxy-alpha-L-mannopyranosyl)oxy]phenyl]methyl]-, O-ethyl ester, (E)-

C18H25NO7S (399.1352)


   

Deoxycylindrospermopsin zwitterion

Deoxycylindrospermopsin zwitterion

C15H21N5O6S (399.1212)


   

S-adenosyl-L-(2 hydroxyl-4-methylthio)butyrate

S-adenosyl-L-(2 hydroxyl-4-methylthio)butyrate

C15H21N5O6S (399.1212)


   

CP 91149; CP91149; Unii-O8EV00W45A

CP 91149; CP91149; Unii-O8EV00W45A

C21H22ClN3O3 (399.135)


   

5,6-dihydro-4H-cyclopenta[b]thiophene-2-carboxylic acid [2-[(1,1-dioxo-3-thiolanyl)-(2-methylpropyl)amino]-2-oxoethyl] ester

5,6-dihydro-4H-cyclopenta[b]thiophene-2-carboxylic acid [2-[(1,1-dioxo-3-thiolanyl)-(2-methylpropyl)amino]-2-oxoethyl] ester

C18H25NO5S2 (399.1174)


   

5-[[4-(4-Acetylphenyl)-1-piperazinyl]sulfonyl]-1,3-dihydroindol-2-one

5-[[4-(4-Acetylphenyl)-1-piperazinyl]sulfonyl]-1,3-dihydroindol-2-one

C20H21N3O4S (399.1253)


   

N-(2,5-dimethoxybenzylidene)-5-({4-nitro-1H-pyrazol-1-yl}methyl)-2-furohydrazide

N-(2,5-dimethoxybenzylidene)-5-({4-nitro-1H-pyrazol-1-yl}methyl)-2-furohydrazide

C18H17N5O6 (399.1179)


   

3-[4-(4-Chlorophenyl)piperazin-1-yl]-1-(4-methoxyphenyl)pyrrolidine-2,5-dione

3-[4-(4-Chlorophenyl)piperazin-1-yl]-1-(4-methoxyphenyl)pyrrolidine-2,5-dione

C21H22ClN3O3 (399.135)


   

5-chloro-2-methoxy-N-[[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]-N-propan-2-ylbenzamide

5-chloro-2-methoxy-N-[[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]-N-propan-2-ylbenzamide

C21H22ClN3O3 (399.135)


   

3-(3-chlorophenyl)-1-(3-hydroxypropyl)-1-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]urea

3-(3-chlorophenyl)-1-(3-hydroxypropyl)-1-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]urea

C21H22ClN3O3 (399.135)


   

3-ethyl-1-(2-furanylmethyl)-1-[(7-oxo-3,6-dihydro-2H-[1,4]dioxino[2,3-g]quinolin-8-yl)methyl]thiourea

3-ethyl-1-(2-furanylmethyl)-1-[(7-oxo-3,6-dihydro-2H-[1,4]dioxino[2,3-g]quinolin-8-yl)methyl]thiourea

C20H21N3O4S (399.1253)


   
   
   
   
   
   
   

2-imino-2-methoxyethyl alpha-D-arabinofuranosyl-(1->6)-1-thio-alpha-D-mannopyranoside

2-imino-2-methoxyethyl alpha-D-arabinofuranosyl-(1->6)-1-thio-alpha-D-mannopyranoside

C14H25NO10S (399.1199)


   

Alanycarb 100 microg/mL in Cyclohexane

Alanycarb 100 microg/mL in Cyclohexane

C17H25N3O4S2 (399.1286)


   

2-Amino-3-[2,3-di(butanoyloxy)propoxy-hydroxyphosphoryl]oxypropanoic acid

2-Amino-3-[2,3-di(butanoyloxy)propoxy-hydroxyphosphoryl]oxypropanoic acid

C14H26NO10P (399.1294)


   
   
   
   
   
   

2-Amino-3-[hydroxy-(2-pentanoyloxy-3-propanoyloxypropoxy)phosphoryl]oxypropanoic acid

2-Amino-3-[hydroxy-(2-pentanoyloxy-3-propanoyloxypropoxy)phosphoryl]oxypropanoic acid

C14H26NO10P (399.1294)


   

3-[(3-Acetyloxy-2-hexanoyloxypropoxy)-hydroxyphosphoryl]oxy-2-aminopropanoic acid

3-[(3-Acetyloxy-2-hexanoyloxypropoxy)-hydroxyphosphoryl]oxy-2-aminopropanoic acid

C14H26NO10P (399.1294)


   

Narcotoline

Narcotoline

C21H21NO7 (399.1318)


D002492 - Central Nervous System Depressants > D009294 - Narcotics > D053610 - Opiate Alkaloids

   
   

7-TFA-ap-7-Deaza-dA

7-TFA-ap-7-Deaza-dA

C16H16F3N5O4 (399.1154)


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

   

PF-06795071

PF-06795071

C18H17F4N3O3 (399.1206)


PF-06795071 is a potent and selective covalent MAGL inhibitor with an IC50 of 3 nM[1].

   

6-[4-({[ethoxy(sulfanyl)methylidene]amino}methyl)phenoxy]-4,5-dihydroxy-2-methyloxan-3-yl acetate

6-[4-({[ethoxy(sulfanyl)methylidene]amino}methyl)phenoxy]-4,5-dihydroxy-2-methyloxan-3-yl acetate

C18H25NO7S (399.1352)


   

methyl (12s)-16-hydroxy-7,17-dimethoxy-3,5-dioxa-11-azapentacyclo[10.7.1.0²,⁶.0⁸,²⁰.0¹⁴,¹⁹]icosa-1(20),2(6),7,14,16,18-hexaene-11-carboxylate

methyl (12s)-16-hydroxy-7,17-dimethoxy-3,5-dioxa-11-azapentacyclo[10.7.1.0²,⁶.0⁸,²⁰.0¹⁴,¹⁹]icosa-1(20),2(6),7,14,16,18-hexaene-11-carboxylate

C21H21NO7 (399.1318)


   

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

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

C23H17N3O4 (399.1219)


   

bisindolylpyrrole cpb-53-594-3

NA

C23H17N3O4 (399.1219)


{"Ingredient_id": "HBIN018624","Ingredient_name": "bisindolylpyrrole cpb-53-594-3","Alias": "NA","Ingredient_formula": "C23H17N3O4","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "2473","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   

(3s)-7-hydroxy-6-methoxy-3-[(5r)-4-methoxy-6-methyl-2h,5h,7h,8h-[1,3]dioxolo[4,5-g]isoquinolin-5-yl]-3h-2-benzofuran-1-one

(3s)-7-hydroxy-6-methoxy-3-[(5r)-4-methoxy-6-methyl-2h,5h,7h,8h-[1,3]dioxolo[4,5-g]isoquinolin-5-yl]-3h-2-benzofuran-1-one

C21H21NO7 (399.1318)


   

8-hydroxy-6',7,7'-trimethoxy-2'-methyl-3',4'-dihydrospiro[2-benzopyran-3,1'-isoquinoline]-1,4-dione

8-hydroxy-6',7,7'-trimethoxy-2'-methyl-3',4'-dihydrospiro[2-benzopyran-3,1'-isoquinoline]-1,4-dione

C21H21NO7 (399.1318)


   

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

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

C15H21N5O6S (399.1212)


   

10-({6-[2-(dimethylamino)ethyl]-2h-1,3-benzodioxol-5-yl}(hydroxy)methyl)-3,5,11-trioxatricyclo[7.3.0.0²,⁶]dodeca-1(9),2(6),7-trien-12-one

10-({6-[2-(dimethylamino)ethyl]-2h-1,3-benzodioxol-5-yl}(hydroxy)methyl)-3,5,11-trioxatricyclo[7.3.0.0²,⁶]dodeca-1(9),2(6),7-trien-12-one

C21H21NO7 (399.1318)


   

(10s)-10-[(r)-{6-[2-(dimethylamino)ethyl]-2h-1,3-benzodioxol-5-yl}(hydroxy)methyl]-3,5,11-trioxatricyclo[7.3.0.0²,⁶]dodeca-1(9),2(6),7-trien-12-one

(10s)-10-[(r)-{6-[2-(dimethylamino)ethyl]-2h-1,3-benzodioxol-5-yl}(hydroxy)methyl]-3,5,11-trioxatricyclo[7.3.0.0²,⁶]dodeca-1(9),2(6),7-trien-12-one

C21H21NO7 (399.1318)


   

(2s,3r,4s,5r,6s)-6-[4-({[ethoxy(sulfanyl)methylidene]amino}methyl)phenoxy]-4,5-dihydroxy-2-methyloxan-3-yl acetate

(2s,3r,4s,5r,6s)-6-[4-({[ethoxy(sulfanyl)methylidene]amino}methyl)phenoxy]-4,5-dihydroxy-2-methyloxan-3-yl acetate

C18H25NO7S (399.1352)