Exact Mass: 362.093433

Exact Mass Matches: 362.093433

Found 150 metabolites which its exact mass value is equals to given mass value 362.093433, within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error 0.001 dalton.

Chelirubine

Chelirubine

C21H16NO5+ (362.10284260000003)


A benzophenanthridine alkaloid that is sanguinarine bearing a methoxy substituent at position 10.

   

5,7-dihydroxy-2-(3-hydroxy-4-methoxyphenyl)-3,6-dimethoxy-3,4-dihydro-2H-1-benzopyran-4-one

5,7-dihydroxy-2-(3-hydroxy-4-methoxyphenyl)-3,6-dimethoxy-3,4-dihydro-2H-1-benzopyran-4-one

C18H18O8 (362.1001628)


   

7-O-Galloyl-sedoheptulose

(2,3,4,5,7-Pentahydroxy-6-oxoheptyl) 3,4,5-trihydroxybenzoate

C14H18O11 (362.0849078)


   

4,5-Diaminofluorescein

5,6-diamino-3,6-dihydroxy-3H-spiro[2-benzofuran-1,9-xanthene]-3-one

C20H14N2O5 (362.0902674)


   

Piretanide

4-phenoxy-3-(pyrrolidin-1-yl)-5-sulfamoylbenzoic acid

C17H18N2O5S (362.0936378)


D045283 - Natriuretic Agents > D004232 - Diuretics > D049994 - Sodium Potassium Chloride Symporter Inhibitors C - Cardiovascular system > C03 - Diuretics > C03C - High-ceiling diuretics > C03CA - Sulfonamides, plain C78275 - Agent Affecting Blood or Body Fluid > C448 - Diuretic > C49184 - Loop Diuretic D002317 - Cardiovascular Agents > D045283 - Natriuretic Agents D049990 - Membrane Transport Modulators

   

3',6'-Dihydroxy-4,5-diaminospiro[isobenzofuran-1(3H),9'-[9H]xanthene]-3-one

3,6-Dihydroxy-4,5-diaminospiro[isobenzofuran-1(3H),9-[9H]xanthene]-3-one

C20H14N2O5 (362.0902674)


   

Pentazirinocyclodiphosphathiazene

pentakis(aziridin-1-yl)-1lambda6,2,4,6,3lambda5,5lambda5-thiatriazadiphosphinin-1-one

C10H20N8OP2S (362.095597)


   

2,3-Dihydroirigenin

5,7,3-Trihydroxy-6,4,5-trimethoxyisoflavanone

C18H18O8 (362.1001628)


   
   

(diacetoxy[?]yl)methyl benzoate

(diacetoxy[?]yl)methyl benzoate

C18H18O8 (362.1001628)


   

5,7,3-Trihydroxy-6,4,5-trimethoxyflavanone

5,7,3-Trihydroxy-6,4,5-trimethoxyflavanone

C18H18O8 (362.1001628)


   
   
   

8-O-Methylasterric acid

8-O-Methylasterric acid

C18H18O8 (362.1001628)


   
   
   

4-O-methyl erythrostominone

4-O-methyl erythrostominone

C18H18O8 (362.1001628)


   

7,8-Di-Me ether-3-(3,4-Dihydroxybenzyl)-5,6,7,8-tetrahydroxy-4-chromanone

7,8-Di-Me ether-3-(3,4-Dihydroxybenzyl)-5,6,7,8-tetrahydroxy-4-chromanone

C18H18O8 (362.1001628)


   
   

4beta-carboxymethyl-(-)-epicatechin methyl ester

4beta-carboxymethyl-(-)-epicatechin methyl ester

C18H18O8 (362.1001628)


   

1-hydroxy-2,3,4,5,7-pentamethoxyxanthone

1-hydroxy-2,3,4,5,7-pentamethoxyxanthone

C18H18O8 (362.1001628)


   

depside atranorin|Homodiploschistesinsaeure-methylester

depside atranorin|Homodiploschistesinsaeure-methylester

C18H18O8 (362.1001628)


   
   

Secosterigmatocystin

Secosterigmatocystin

C18H18O8 (362.1001628)


D009676 - Noxae > D011042 - Poisons > D009183 - Mycotoxins

   
   

Methyl 18-Bromo-(17Z)-octadeca-17-ene-5,7,15-triynoate

Methyl 18-Bromo-(17Z)-octadeca-17-ene-5,7,15-triynoate

C19H23BrO2 (362.0881318)


   

2-caffeoyloxy-3-hydroxy-3-(3,4-dihydroxyphenyl)propyl alcohol

2-caffeoyloxy-3-hydroxy-3-(3,4-dihydroxyphenyl)propyl alcohol

C18H18O8 (362.1001628)


   
   
   

ethyl (+)-cyanidan-3-ol-8-carboxylate

ethyl (+)-cyanidan-3-ol-8-carboxylate

C18H18O8 (362.1001628)


   

3-(3-Hydroxy-4-methoxybenzyl)-3,5,6-trihydroxy-7-methoxychroman-4-one

3-(3-Hydroxy-4-methoxybenzyl)-3,5,6-trihydroxy-7-methoxychroman-4-one

C18H18O8 (362.1001628)


   

2,5,6-Trihydroxy-6,7,8-trimethoxyflavanone

2,5,6-Trihydroxy-6,7,8-trimethoxyflavanone

C18H18O8 (362.1001628)


   
   

3-acetoxy-4-deoxybostrycin

3-acetoxy-4-deoxybostrycin

C18H18O8 (362.1001628)


   

5,2,4-trihydroxy-6,7,5-trimethoxyflavone

5,2,4-trihydroxy-6,7,5-trimethoxyflavone

C18H18O8 (362.1001628)


   

Decarboxyhypothamnolic acid

Decarboxyhypothamnolic acid

C18H18O8 (362.1001628)


   

4,5-dihydro-2-(4-hydroxy-3-methoxyphenyl)-3H-furo[2,3,4-kl]pyrrolo[4,3,2-fg][3]benzazocine-3,6(8H)-dionem|calanthumindole

4,5-dihydro-2-(4-hydroxy-3-methoxyphenyl)-3H-furo[2,3,4-kl]pyrrolo[4,3,2-fg][3]benzazocine-3,6(8H)-dionem|calanthumindole

C20H14N2O5 (362.0902674)


   

hypoalectorialic acid

hypoalectorialic acid

C18H18O8 (362.1001628)


   

Methyl 18-Bromo-(9Z,15Z,17E)-octadeca-9,15,17-triene-5,7-diynoate

Methyl 18-Bromo-(9Z,15Z,17E)-octadeca-9,15,17-triene-5,7-diynoate

C19H23BrO2 (362.0881318)


   

O1-(4-phenoxy-phenyl)-beta-D-glucopyranuronic acid|O1-(4-Phenoxy-phenyl)-beta-D-glucopyranuronsaeure

O1-(4-phenoxy-phenyl)-beta-D-glucopyranuronic acid|O1-(4-Phenoxy-phenyl)-beta-D-glucopyranuronsaeure

C18H18O8 (362.1001628)


   
   

DAF-2

2-(3,6-dihydroxy-4,5-diamino-9H-xanthen-9-yl)-benzoic acid

C20H14N2O5 (362.0902674)


D004396 - Coloring Agents > D005456 - Fluorescent Dyes > D005452 - Fluoresceins D019995 - Laboratory Chemicals > D007202 - Indicators and Reagents

   
   

(-)-Cleistenolide

(-)-Cleistenolide

C18H18O8 (362.1001628)


   

3,8-dihydroxy-1-methoxy-4-(1,3,4-trihydroxybutan-2-yl)xanthen-9-one

NCGC00380612-01!3,8-dihydroxy-1-methoxy-4-(1,3,4-trihydroxybutan-2-yl)xanthen-9-one

C18H18O8 (362.1001628)


   

methyl 2-hydroxy-6-(4-hydroxy-2-methoxy-6-methoxycarbonylphenoxy)-4-methylbenzoate

NCGC00180813-03!methyl 2-hydroxy-6-(4-hydroxy-2-methoxy-6-methoxycarbonylphenoxy)-4-methylbenzoate

C18H18O8 (362.1001628)


   

methyl 2-hydroxy-6-(2-hydroxy-4-methoxy-6-methoxycarbonylphenoxy)-4-methylbenzoate

NCGC00381149-01!methyl 2-hydroxy-6-(2-hydroxy-4-methoxy-6-methoxycarbonylphenoxy)-4-methylbenzoate

C18H18O8 (362.1001628)


   

Piretanide

Piretanide

C17H18N2O5S (362.0936378)


D045283 - Natriuretic Agents > D004232 - Diuretics > D049994 - Sodium Potassium Chloride Symporter Inhibitors C - Cardiovascular system > C03 - Diuretics > C03C - High-ceiling diuretics > C03CA - Sulfonamides, plain C78275 - Agent Affecting Blood or Body Fluid > C448 - Diuretic > C49184 - Loop Diuretic D002317 - Cardiovascular Agents > D045283 - Natriuretic Agents D049990 - Membrane Transport Modulators

   

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

NCGC00381149-01!methyl 2-hydroxy-6-(2-hydroxy-4-methoxy-6-methoxycarbonylphenoxy)-4-methylbenzoate [IIN-based: Match]

C18H18O8 (362.1001628)


   

methyl 2-hydroxy-6-(2-hydroxy-4-methoxy-6-methoxycarbonylphenoxy)-4-methylbenzoate [IIN-based on: CCMSLIB00000848992]

NCGC00381149-01!methyl 2-hydroxy-6-(2-hydroxy-4-methoxy-6-methoxycarbonylphenoxy)-4-methylbenzoate [IIN-based on: CCMSLIB00000848992]

C18H18O8 (362.1001628)


   

FR140423

3-(Difluoromethyl)-1-(4-methoxyphenyl)-5-(4-(methylsulfinyl)phenyl)pyrazole

C18H16F2N2O2S (362.09004999999996)


CONFIDENCE standard compound; INTERNAL_ID 660; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8446; ORIGINAL_PRECURSOR_SCAN_NO 8442 CONFIDENCE standard compound; INTERNAL_ID 660; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8470; ORIGINAL_PRECURSOR_SCAN_NO 8469 CONFIDENCE standard compound; INTERNAL_ID 660; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8485; ORIGINAL_PRECURSOR_SCAN_NO 8483 CONFIDENCE standard compound; INTERNAL_ID 660; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8519; ORIGINAL_PRECURSOR_SCAN_NO 8516 CONFIDENCE standard compound; INTERNAL_ID 660; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8520; ORIGINAL_PRECURSOR_SCAN_NO 8517 CONFIDENCE standard compound; INTERNAL_ID 660; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8527; ORIGINAL_PRECURSOR_SCAN_NO 8525

   

Methyl 18-bromooctadec-17-en-5,7,15-triynoate

Methyl 18-bromo-17E-octadecen-5,7,15-triynoate

C19H23BrO2 (362.0881318)


   

Methyl 18-bromo-17Z-octadecen-5,7,15-triynoate

Methyl 18-bromo-17Z-octadecen-5,7,15-triynoate

C19H23BrO2 (362.0881318)


   

Methyl 18-bromo-9E,15E,17E-octadecatrien-5,7-diynoate

Methyl 18-bromo-9E,15E,17E-octadecatrien-5,7-diynoate

C19H23BrO2 (362.0881318)


   

Methyl 18-bromooctadec-17-en-5,7,15-triynoate

Methyl 18-bromo-17E-octadecen-5,7,15-triynoate

C19H23O2Br (362.0881318)


   

Methyl 18-bromo-17Z-octadecen-5,7,15-triynoate

Methyl 18-bromo-17Z-octadecen-5,7,15-triynoate

C19H23O2Br (362.0881318)


   

Methyl 18-bromo-9E,15E,17E-octadecatrien-5,7-diynoate

Methyl 18-bromo-9E,15E,17E-octadecatrien-5,7-diynoate

C19H23O2Br (362.0881318)


   

5-BROMO-2-(2,4-DI-TERT-BUTYLPHENOXY)PYRIMIDINE

5-BROMO-2-(2,4-DI-TERT-BUTYLPHENOXY)PYRIMIDINE

C18H23BrN2O (362.0993648)


   

Methyl 4,6-diacetoxy-5,7-dimethoxy-2-naphthoate

Methyl 4,6-diacetoxy-5,7-dimethoxy-2-naphthoate

C18H18O8 (362.1001628)


   

Pyrano[2,3-c]pyrazole-5-carbonitrile,6-amino-4-(4-chlorophenyl)-1,4-dihydro-3-methyl-1-phenyl-

Pyrano[2,3-c]pyrazole-5-carbonitrile,6-amino-4-(4-chlorophenyl)-1,4-dihydro-3-methyl-1-phenyl-

C20H15ClN4O (362.093433)


   

N4-(3-Chloro-4-fluorophenyl)-7-(2-methoxyethoxy)quinazoline-4,6-diamine

N4-(3-Chloro-4-fluorophenyl)-7-(2-methoxyethoxy)quinazoline-4,6-diamine

C17H16ClFN4O2 (362.0945758)


   

3-cyclopentyl-2-(3,4-dichlorophenyl)-N-pyridin-2-ylpropanamide

3-cyclopentyl-2-(3,4-dichlorophenyl)-N-pyridin-2-ylpropanamide

C19H20Cl2N2O (362.095261)


   
   
   

(R)-3-((6,7,8,9-TETRAHYDRO-5H-BENZO[7]ANNULEN-5-YL)THIO)-5-UREIDOISOTHIAZOLE-4-CARBOXAMIDE

(R)-3-((6,7,8,9-TETRAHYDRO-5H-BENZO[7]ANNULEN-5-YL)THIO)-5-UREIDOISOTHIAZOLE-4-CARBOXAMIDE

C16H18N4O2S2 (362.0871128)


   

1,5-diamino-4,8-dihydroxy(4-hydroxyphenyl)anthraquinone

1,5-diamino-4,8-dihydroxy(4-hydroxyphenyl)anthraquinone

C20H14N2O5 (362.0902674)


   

4-[(6-methoxy-3-methyl-1,3-benzothiazol-3-ium-2-yl)diazenyl]-N,N-dimethylaniline,chloride

4-[(6-methoxy-3-methyl-1,3-benzothiazol-3-ium-2-yl)diazenyl]-N,N-dimethylaniline,chloride

C17H19ClN4OS (362.0968034)


   
   

2-phenoxyethoxycarbonyloxy 2-phenoxyethyl carbonate

2-phenoxyethoxycarbonyloxy 2-phenoxyethyl carbonate

C18H18O8 (362.1001628)


   
   
   

Trimethyl[1-(2,6-xylylcarbamoyl)ethyl]ammonium iodide

Trimethyl[1-(2,6-xylylcarbamoyl)ethyl]ammonium iodide

C14H23IN2O (362.08550579999996)


   
   
   

Pentazirinocyclodiphosphathiazene

Pentazirinocyclodiphosphathiazene

C10H20N8OP2S (362.095597)


   

N-[3-cyano-4-[(4-methylphenyl)thio]phenyl]-4-fluorobenzamide

N-[3-cyano-4-[(4-methylphenyl)thio]phenyl]-4-fluorobenzamide

C21H15FN2OS (362.0889072)


   

(Z)-5-[(5-hydroxy-7-methoxy-2-methyl-4-oxochromen-6-yl)methoxy]-3-methyl-5-oxopent-3-enoic acid

(Z)-5-[(5-hydroxy-7-methoxy-2-methyl-4-oxochromen-6-yl)methoxy]-3-methyl-5-oxopent-3-enoic acid

C18H18O8 (362.1001628)


   

3-{5-[Amino(iminio)methyl]-6-chloro-1H-benzimidazol-2-YL}-1,1-biphenyl-2-olate

3-{5-[Amino(iminio)methyl]-6-chloro-1H-benzimidazol-2-YL}-1,1-biphenyl-2-olate

C20H15ClN4O (362.093433)


   

Methyl 2-hydroxy-6-(4-hydroxy-2-methoxy-6-methoxycarbonylphenoxy)-4-methylbenzoate

Methyl 2-hydroxy-6-(4-hydroxy-2-methoxy-6-methoxycarbonylphenoxy)-4-methylbenzoate

C18H18O8 (362.1001628)


   

5,7-Dihydroxy-2-(3-hydroxy-4-methoxyphenyl)-3,6-dimethoxy-2,3-dihydrochromen-4-one

5,7-Dihydroxy-2-(3-hydroxy-4-methoxyphenyl)-3,6-dimethoxy-2,3-dihydrochromen-4-one

C18H18O8 (362.1001628)


   

4-Acetyl-6-(3-acetyl-2,4,6-trihydroxy-5-methylphenyl)-3,5-dihydroxy-6-methylcyclohexa-2,4-dien-1-one

4-Acetyl-6-(3-acetyl-2,4,6-trihydroxy-5-methylphenyl)-3,5-dihydroxy-6-methylcyclohexa-2,4-dien-1-one

C18H18O8 (362.1001628)


   

7,8-Didemethyl-8-hydroxy-5-deazariboflavin(1-)

7,8-Didemethyl-8-hydroxy-5-deazariboflavin(1-)

C16H16N3O7- (362.09882059999995)


   

6-(O-beta-D-glucopyranosyl) camalexin

6-(O-beta-D-glucopyranosyl) camalexin

C17H18N2O5S (362.0936378)


   

5-Chloro-7-[3-pyridinyl-(2-pyridinylamino)methyl]-8-quinolinol

5-Chloro-7-[3-pyridinyl-(2-pyridinylamino)methyl]-8-quinolinol

C20H15ClN4O (362.093433)


   

6-(1,3-benzodioxol-5-yl)-N-(2-thiazolylmethyl)-4-quinazolinamine

6-(1,3-benzodioxol-5-yl)-N-(2-thiazolylmethyl)-4-quinazolinamine

C19H14N4O2S (362.0837424)


   

4-(6-Amino-5-cyano-3-methyl-1,4-dihydropyrano[2,3-c]pyrazol-4-yl)phenyl 2-furoate

4-(6-Amino-5-cyano-3-methyl-1,4-dihydropyrano[2,3-c]pyrazol-4-yl)phenyl 2-furoate

C19H14N4O4 (362.1015004)


   

4-chloro-N-[4-[3-(methylthio)anilino]-4-oxobutyl]benzamide

4-chloro-N-[4-[3-(methylthio)anilino]-4-oxobutyl]benzamide

C18H19ClN2O2S (362.0855704)


   

2-[(5-cyano-4-oxo-6-phenyl-1H-pyrimidin-2-yl)thio]-N-phenylacetamide

2-[(5-cyano-4-oxo-6-phenyl-1H-pyrimidin-2-yl)thio]-N-phenylacetamide

C19H14N4O2S (362.0837424)


   

6-(3-Aminopropoxy)-4-(3-chloro-4-fluoroanilino)quinazolin-7-ol

6-(3-Aminopropoxy)-4-(3-chloro-4-fluoroanilino)quinazolin-7-ol

C17H16ClFN4O2 (362.0945758)


   

4-[2,4-Dihydroxy-3-(hydroxymethyl)-6-methylbenzoyl]oxy-2-hydroxy-3,6-dimethylbenzoic acid

4-[2,4-Dihydroxy-3-(hydroxymethyl)-6-methylbenzoyl]oxy-2-hydroxy-3,6-dimethylbenzoic acid

C18H18O8 (362.1001628)


   

BPDBA

BPDBA

C19H20Cl2N2O (362.095261)


BPDBA is a selective and noncompetitive betaine/GABA transporter (BGT-1) inhibitor with IC50s of 20 μM and 35 μM against human BGT-1 and mouse GAT2, respectively[1].

   

BZAD-01

BZAD-01

C16H12F6N2O (362.08537739999997)


BZAD-01 is a potent, selective and orally active inhibitor of NMDA NR2B subunit, with a Ki of 72 nM. BZAD-01 can improve postural asymmetry as well as Apomorphine-induced rotation[1].

   

(1s,2e,4e)-1-[(1r,6s)-4-[(acetyloxy)methyl]-2,5-dioxo-7-oxabicyclo[4.1.0]hept-3-en-1-yl]-3-methyl-6-oxohexa-2,4-dien-1-yl acetate

(1s,2e,4e)-1-[(1r,6s)-4-[(acetyloxy)methyl]-2,5-dioxo-7-oxabicyclo[4.1.0]hept-3-en-1-yl]-3-methyl-6-oxohexa-2,4-dien-1-yl acetate

C18H18O8 (362.1001628)


   

(2s)-2-(2,6-dihydroxyphenyl)-5-hydroxy-6,7,8-trimethoxy-2,3-dihydro-1-benzopyran-4-one

(2s)-2-(2,6-dihydroxyphenyl)-5-hydroxy-6,7,8-trimethoxy-2,3-dihydro-1-benzopyran-4-one

C18H18O8 (362.1001628)


   

methyl (9z,15z,17e)-18-bromooctadeca-9,15,17-trien-5,7-diynoate

methyl (9z,15z,17e)-18-bromooctadeca-9,15,17-trien-5,7-diynoate

C19H23BrO2 (362.0881318)


   

1-hydroxy-2,3,4,5,7-pentamethoxyxanthen-9-one

1-hydroxy-2,3,4,5,7-pentamethoxyxanthen-9-one

C18H18O8 (362.1001628)


   

6-[(2,4-dihydroxy-3,6-dimethylbenzoyloxy)methyl]-2,4-dihydroxy-3-methylbenzoic acid

6-[(2,4-dihydroxy-3,6-dimethylbenzoyloxy)methyl]-2,4-dihydroxy-3-methylbenzoic acid

C18H18O8 (362.1001628)


   

3,8-dihydroxy-1-methoxy-4-[(2r,3s)-1,3,4-trihydroxybutan-2-yl]xanthen-9-one

3,8-dihydroxy-1-methoxy-4-[(2r,3s)-1,3,4-trihydroxybutan-2-yl]xanthen-9-one

C18H18O8 (362.1001628)


   

(2r,4s)-5,10-dihydroxy-4,8-dimethoxy-2-(2-oxopropyl)-2h,3h,4h-naphtho[2,3-b]pyran-6,9-dione

(2r,4s)-5,10-dihydroxy-4,8-dimethoxy-2-(2-oxopropyl)-2h,3h,4h-naphtho[2,3-b]pyran-6,9-dione

C18H18O8 (362.1001628)


   

5-(4-hydroxy-7-methoxy-6-methyl-2h-1,3-benzodioxol-5-yl)-7-methoxy-6-methyl-2h-1,3-benzodioxol-4-ol

5-(4-hydroxy-7-methoxy-6-methyl-2h-1,3-benzodioxol-5-yl)-7-methoxy-6-methyl-2h-1,3-benzodioxol-4-ol

C18H18O8 (362.1001628)


   

3-[(3,4-dihydroxyphenyl)methyl]-5,6-dihydroxy-7,8-dimethoxy-2,3-dihydro-1-benzopyran-4-one

3-[(3,4-dihydroxyphenyl)methyl]-5,6-dihydroxy-7,8-dimethoxy-2,3-dihydro-1-benzopyran-4-one

C18H18O8 (362.1001628)


   

2,3-dihydroirigenin

NA

C18H18O8 (362.1001628)


{"Ingredient_id": "HBIN004022","Ingredient_name": "2,3-dihydroirigenin","Alias": "NA","Ingredient_formula": "C18H18O8","Ingredient_Smile": "COC1=CC(=CC(=C1OC)O)C2COC3=CC(=C(C(=C3C2=O)O)OC)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "SMIT15075","TCMID_id": "5646","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   

2-caffeoyloxy-3-hydroxy-3-(3,4-dihydroxy-phenyl)propyl alcohol

NA

C18H18O8 (362.1001628)


{"Ingredient_id": "HBIN005434","Ingredient_name": "2-caffeoyloxy-3-hydroxy-3-(3,4-dihydroxy-phenyl)propyl alcohol","Alias": "NA","Ingredient_formula": "C18H18O8","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "2915","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   

4- o -methylerythrostominone

NA

C18H18O8 (362.1001628)


{"Ingredient_id": "HBIN010783","Ingredient_name": "4- o -methylerythrostominone","Alias": "NA","Ingredient_formula": "C18H18O8","Ingredient_Smile": "CC(=O)CC1CC(C2=C(C3=C(C(=C2O1)O)C(=O)C(=CC3=O)OC)O)OC","Ingredient_weight": "362.3 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "7986","PubChem_id": "101036749","DrugBank_id": "NA"}

   

8-Methoxysangu inarine

NA

C21H16NO5+ (362.10284260000003)


{"Ingredient_id": "HBIN013821","Ingredient_name": "8-Methoxysangu inarine","Alias": "NA","Ingredient_formula": "C21H16NO5+","Ingredient_Smile": "C[N+]1=C2C(=C3C=CC4=C(C3=C1OC)OCO4)C=CC5=CC6=C(C=C52)OCO6","Ingredient_weight": "362.4 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "37098","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "101839187","DrugBank_id": "NA"}

   

{6-[1-(acetyloxy)-3-methyl-6-oxohexa-2,4-dien-1-yl]-2,5-dioxo-7-oxabicyclo[4.1.0]hept-3-en-3-yl}methyl acetate

{6-[1-(acetyloxy)-3-methyl-6-oxohexa-2,4-dien-1-yl]-2,5-dioxo-7-oxabicyclo[4.1.0]hept-3-en-3-yl}methyl acetate

C18H18O8 (362.1001628)


   

(2r,4s)-6,9-dihydroxy-4,8-dimethoxy-2-(2-oxopropyl)-2h,3h,4h-naphtho[2,3-b]pyran-5,10-dione

(2r,4s)-6,9-dihydroxy-4,8-dimethoxy-2-(2-oxopropyl)-2h,3h,4h-naphtho[2,3-b]pyran-5,10-dione

C18H18O8 (362.1001628)


   

(2s,3r)-2,5,7-trihydroxy-3-[(s)-hydroxy(4-hydroxyphenyl)methyl]-6-methoxy-8-methyl-2,3-dihydro-1-benzopyran-4-one

(2s,3r)-2,5,7-trihydroxy-3-[(s)-hydroxy(4-hydroxyphenyl)methyl]-6-methoxy-8-methyl-2,3-dihydro-1-benzopyran-4-one

C18H18O8 (362.1001628)


   

3,8-dihydroxy-1-methoxy-4-[(2s,3s)-1,3,4-trihydroxybutan-2-yl]xanthen-9-one

3,8-dihydroxy-1-methoxy-4-[(2s,3s)-1,3,4-trihydroxybutan-2-yl]xanthen-9-one

C18H18O8 (362.1001628)


   

2,5,7-trihydroxy-3-[hydroxy(4-hydroxyphenyl)methyl]-6-methoxy-8-methyl-2,3-dihydro-1-benzopyran-4-one

2,5,7-trihydroxy-3-[hydroxy(4-hydroxyphenyl)methyl]-6-methoxy-8-methyl-2,3-dihydro-1-benzopyran-4-one

C18H18O8 (362.1001628)


   

(1r,2s,11r,13s)-1,6-dihydroxy-8-methoxy-13,15-dimethyl-3,12,14-trioxapentacyclo[11.4.1.0²,¹¹.0⁵,¹⁰.0¹¹,¹⁵]octadeca-5,7,9-triene-4,17-dione

(1r,2s,11r,13s)-1,6-dihydroxy-8-methoxy-13,15-dimethyl-3,12,14-trioxapentacyclo[11.4.1.0²,¹¹.0⁵,¹⁰.0¹¹,¹⁵]octadeca-5,7,9-triene-4,17-dione

C18H18O8 (362.1001628)


   

15-chloro-6,14-dihydroxy-4,12-dipropyl-2,9-dioxatricyclo[9.4.0.0³,⁸]pentadeca-1(15),3(8),4,6,11,13-hexaen-10-one

15-chloro-6,14-dihydroxy-4,12-dipropyl-2,9-dioxatricyclo[9.4.0.0³,⁸]pentadeca-1(15),3(8),4,6,11,13-hexaen-10-one

C19H19ClO5 (362.0920954)


   

[(1r,2r,4r,5s,6r,7s)-5,6-bis(acetyloxy)-3,8-dioxatricyclo[5.1.0.0²,⁴]octan-4-yl]methyl benzoate

[(1r,2r,4r,5s,6r,7s)-5,6-bis(acetyloxy)-3,8-dioxatricyclo[5.1.0.0²,⁴]octan-4-yl]methyl benzoate

C18H18O8 (362.1001628)


   

methyl (17e)-18-bromooctadeca-9,15,17-trien-5,7-diynoate

methyl (17e)-18-bromooctadeca-9,15,17-trien-5,7-diynoate

C19H23BrO2 (362.0881318)


   

3,5,6-trihydroxy-3-[(3-hydroxy-4-methoxyphenyl)methyl]-7-methoxy-2h-1-benzopyran-4-one

3,5,6-trihydroxy-3-[(3-hydroxy-4-methoxyphenyl)methyl]-7-methoxy-2h-1-benzopyran-4-one

C18H18O8 (362.1001628)


   

methyl (17e)-18-bromooctadec-17-en-5,7,15-triynoate

methyl (17e)-18-bromooctadec-17-en-5,7,15-triynoate

C19H23BrO2 (362.0881318)


   

methyl 3-hydroxy-2-[3-hydroxy-2-(methoxycarbonyl)-5-methylphenoxy]-5-methoxybenzoate

methyl 3-hydroxy-2-[3-hydroxy-2-(methoxycarbonyl)-5-methylphenoxy]-5-methoxybenzoate

C18H18O8 (362.1001628)


   

8-hydroxy-1,2,3,4,6-pentamethoxyxanthen-9-one

8-hydroxy-1,2,3,4,6-pentamethoxyxanthen-9-one

C18H18O8 (362.1001628)


   

(2s,3r)-5,7-dihydroxy-2-(3-hydroxy-4-methoxyphenyl)-3,6-dimethoxy-2,3-dihydro-1-benzopyran-4-one

(2s,3r)-5,7-dihydroxy-2-(3-hydroxy-4-methoxyphenyl)-3,6-dimethoxy-2,3-dihydro-1-benzopyran-4-one

C18H18O8 (362.1001628)


   

5,7-dihydroxy-3-(3-hydroxy-4,5-dimethoxyphenyl)-6-methoxy-2,3-dihydro-1-benzopyran-4-one

5,7-dihydroxy-3-(3-hydroxy-4,5-dimethoxyphenyl)-6-methoxy-2,3-dihydro-1-benzopyran-4-one

C18H18O8 (362.1001628)


   

(3s)-3,5,6-trihydroxy-3-[(3-hydroxy-4-methoxyphenyl)methyl]-7-methoxy-2h-1-benzopyran-4-one

(3s)-3,5,6-trihydroxy-3-[(3-hydroxy-4-methoxyphenyl)methyl]-7-methoxy-2h-1-benzopyran-4-one

C18H18O8 (362.1001628)


   

1-(3,4-dihydroxyphenyl)-1,3-dihydroxypropan-2-yl 3-(3,4-dihydroxyphenyl)prop-2-enoate

1-(3,4-dihydroxyphenyl)-1,3-dihydroxypropan-2-yl 3-(3,4-dihydroxyphenyl)prop-2-enoate

C18H18O8 (362.1001628)


   

2-hydroxyethyl 2-(2,4-dihydroxy-3-methoxybenzoyl)-3-hydroxy-4-methylbenzoate

2-hydroxyethyl 2-(2,4-dihydroxy-3-methoxybenzoyl)-3-hydroxy-4-methylbenzoate

C18H18O8 (362.1001628)


   

1,6-dihydroxy-8-methoxy-13,15-dimethyl-3,12,14-trioxapentacyclo[11.4.1.0²,¹¹.0⁵,¹⁰.0¹¹,¹⁵]octadeca-5,7,9-triene-4,17-dione

1,6-dihydroxy-8-methoxy-13,15-dimethyl-3,12,14-trioxapentacyclo[11.4.1.0²,¹¹.0⁵,¹⁰.0¹¹,¹⁵]octadeca-5,7,9-triene-4,17-dione

C18H18O8 (362.1001628)


   

methyl 5-hydroxy-2-[3-hydroxy-2-(methoxycarbonyl)-5-methylphenoxy]-3-methoxybenzoate

methyl 5-hydroxy-2-[3-hydroxy-2-(methoxycarbonyl)-5-methylphenoxy]-3-methoxybenzoate

C18H18O8 (362.1001628)


   

(1s,2r,11s,13r)-1,6-dihydroxy-8-methoxy-13,15-dimethyl-3,12,14-trioxapentacyclo[11.4.1.0²,¹¹.0⁵,¹⁰.0¹¹,¹⁵]octadeca-5,7,9-triene-4,17-dione

(1s,2r,11s,13r)-1,6-dihydroxy-8-methoxy-13,15-dimethyl-3,12,14-trioxapentacyclo[11.4.1.0²,¹¹.0⁵,¹⁰.0¹¹,¹⁵]octadeca-5,7,9-triene-4,17-dione

C18H18O8 (362.1001628)


   

methyl (17z)-18-bromooctadec-17-en-5,7,15-triynoate

methyl (17z)-18-bromooctadec-17-en-5,7,15-triynoate

C19H23BrO2 (362.0881318)


   

methyl 2-hydroxy-3,6-dimethyl-4-(2,3,4-trihydroxy-6-methylbenzoyloxy)benzoate

methyl 2-hydroxy-3,6-dimethyl-4-(2,3,4-trihydroxy-6-methylbenzoyloxy)benzoate

C18H18O8 (362.1001628)


   

(2s)-5,7-dihydroxy-2-(3-hydroxy-4,5-dimethoxyphenyl)-6-methoxy-2,3-dihydro-1-benzopyran-4-one

(2s)-5,7-dihydroxy-2-(3-hydroxy-4,5-dimethoxyphenyl)-6-methoxy-2,3-dihydro-1-benzopyran-4-one

C18H18O8 (362.1001628)


   

1-[(3ar,8ar)-6-bromo-1-methyl-3a-(2-methylbut-3-en-2-yl)-2h,3h,8ah-pyrrolo[2,3-b]indol-8-yl]ethanone

1-[(3ar,8ar)-6-bromo-1-methyl-3a-(2-methylbut-3-en-2-yl)-2h,3h,8ah-pyrrolo[2,3-b]indol-8-yl]ethanone

C18H23BrN2O (362.0993648)


   

5,10-dihydroxy-4,8-dimethoxy-2-(2-oxopropyl)-2h,3h,4h-naphtho[2,3-b]pyran-6,9-dione

5,10-dihydroxy-4,8-dimethoxy-2-(2-oxopropyl)-2h,3h,4h-naphtho[2,3-b]pyran-6,9-dione

C18H18O8 (362.1001628)


   

methyl 2-hydroxy-3-[3-hydroxy-2-(methoxycarbonyl)-5-methylphenoxy]-5-methoxybenzoate

methyl 2-hydroxy-3-[3-hydroxy-2-(methoxycarbonyl)-5-methylphenoxy]-5-methoxybenzoate

C18H18O8 (362.1001628)


   

(3r)-5,7-dihydroxy-3-(3-hydroxy-4,5-dimethoxyphenyl)-6-methoxy-2,3-dihydro-1-benzopyran-4-one

(3r)-5,7-dihydroxy-3-(3-hydroxy-4,5-dimethoxyphenyl)-6-methoxy-2,3-dihydro-1-benzopyran-4-one

C18H18O8 (362.1001628)


   

6,9-dihydroxy-4,8-dimethoxy-2-(2-oxopropyl)-2h,3h,4h-naphtho[2,3-b]pyran-5,10-dione

6,9-dihydroxy-4,8-dimethoxy-2-(2-oxopropyl)-2h,3h,4h-naphtho[2,3-b]pyran-5,10-dione

C18H18O8 (362.1001628)


   

13-chloro-6,14-dihydroxy-4,12-dipropyl-2,9-dioxatricyclo[9.4.0.0³,⁸]pentadeca-1(15),3(8),4,6,11,13-hexaen-10-one

13-chloro-6,14-dihydroxy-4,12-dipropyl-2,9-dioxatricyclo[9.4.0.0³,⁸]pentadeca-1(15),3(8),4,6,11,13-hexaen-10-one

C19H19ClO5 (362.0920954)


   

(3r)-3-[(3,4-dihydroxyphenyl)methyl]-5,6-dihydroxy-7,8-dimethoxy-2,3-dihydro-1-benzopyran-4-one

(3r)-3-[(3,4-dihydroxyphenyl)methyl]-5,6-dihydroxy-7,8-dimethoxy-2,3-dihydro-1-benzopyran-4-one

C18H18O8 (362.1001628)


   

(2e,4e)-1-{4-[(acetyloxy)methyl]-2,5-dioxo-7-oxabicyclo[4.1.0]hept-3-en-1-yl}-3-methyl-6-oxohexa-2,4-dien-1-yl acetate

(2e,4e)-1-{4-[(acetyloxy)methyl]-2,5-dioxo-7-oxabicyclo[4.1.0]hept-3-en-1-yl}-3-methyl-6-oxohexa-2,4-dien-1-yl acetate

C18H18O8 (362.1001628)


   

methyl (9e,15z,17e)-18-bromooctadeca-9,15,17-trien-5,7-diynoate

methyl (9e,15z,17e)-18-bromooctadeca-9,15,17-trien-5,7-diynoate

C19H23BrO2 (362.0881318)


   

(1r,2s)-1-(3,4-dihydroxyphenyl)-1,3-dihydroxypropan-2-yl (2e)-3-(3,4-dihydroxyphenyl)prop-2-enoate

(1r,2s)-1-(3,4-dihydroxyphenyl)-1,3-dihydroxypropan-2-yl (2e)-3-(3,4-dihydroxyphenyl)prop-2-enoate

C18H18O8 (362.1001628)


   

(2r)-5,7-dihydroxy-2-(3-hydroxy-4,5-dimethoxyphenyl)-6-methoxy-2,3-dihydro-1-benzopyran-4-one

(2r)-5,7-dihydroxy-2-(3-hydroxy-4,5-dimethoxyphenyl)-6-methoxy-2,3-dihydro-1-benzopyran-4-one

C18H18O8 (362.1001628)


   

1-[6-bromo-1-methyl-3a-(2-methylbut-3-en-2-yl)-2h,3h,8ah-pyrrolo[2,3-b]indol-8-yl]ethanone

1-[6-bromo-1-methyl-3a-(2-methylbut-3-en-2-yl)-2h,3h,8ah-pyrrolo[2,3-b]indol-8-yl]ethanone

C18H23BrN2O (362.0993648)


   

5,7-dihydroxy-2-(3-hydroxy-4,5-dimethoxyphenyl)-6-methoxy-2,3-dihydro-1-benzopyran-4-one

5,7-dihydroxy-2-(3-hydroxy-4,5-dimethoxyphenyl)-6-methoxy-2,3-dihydro-1-benzopyran-4-one

C18H18O8 (362.1001628)


   

3-(2,4-dihydroxy-3,6-dimethylphenoxycarbonyl)-2-hydroxy-6-methoxy-4-methylbenzoic acid

3-(2,4-dihydroxy-3,6-dimethylphenoxycarbonyl)-2-hydroxy-6-methoxy-4-methylbenzoic acid

C18H18O8 (362.1001628)


   

2-[4-hydroxy-2-methoxy-6-(methoxycarbonyl)phenoxy]-6-methoxy-4-methylbenzoic acid

2-[4-hydroxy-2-methoxy-6-(methoxycarbonyl)phenoxy]-6-methoxy-4-methylbenzoic acid

C18H18O8 (362.1001628)


   

methyl 2-[(2r,3r,4s)-2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-3,4-dihydro-2h-1-benzopyran-4-yl]acetate

methyl 2-[(2r,3r,4s)-2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-3,4-dihydro-2h-1-benzopyran-4-yl]acetate

C18H18O8 (362.1001628)


   

methyl 2-[2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-3,4-dihydro-2h-1-benzopyran-4-yl]acetate

methyl 2-[2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-3,4-dihydro-2h-1-benzopyran-4-yl]acetate

C18H18O8 (362.1001628)