Exact Mass: 328.0559

Exact Mass Matches: 328.0559

Found 172 metabolites which its exact mass value is equals to given mass value 328.0559, within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error 0.001 dalton.

Aflatoxin M1

(3R,7R)-3-hydroxy-11-methoxy-6,8,19-trioxapentacyclo[10.7.0.0²,⁹.0³,⁷.0¹³,¹⁷]nonadeca-1(12),2(9),4,10,13(17)-pentaene-16,18-dione

C17H12O7 (328.0583)


Aflatoxin M1 is found in milk and milk products. Minor mycotoxin of Aspergillus flavus, also found in the milk of cows and sheep fed toxic meal. Metab. of Aflatoxin B1 JHZ87-P [CCD].Aflatoxins are naturally occurring mycotoxins that are produced by many species of Aspergillus, a fungus, most notably Aspergillus flavus and Aspergillus parasiticus. Aflatoxins are toxic and among the most carcinogenic substances known. Aflatoxin M1 is a metabolite of aflatoxin B1 in humans and animals. (Wikipedia) D009676 - Noxae > D011042 - Poisons > D009183 - Mycotoxins D009676 - Noxae > D011042 - Poisons > D000348 - Aflatoxins

   

Aflatoxin M1

Cyclopenta(c)furo(3,2:4,5)furo(2,3-h)(1)benzopyran-1,11-dione, 2,3,6a,9a-tetrahydro-9a-hydroxy-4-methoxy-

C17H12O7 (328.0583)


D009676 - Noxae > D011042 - Poisons > D009183 - Mycotoxins D009676 - Noxae > D011042 - Poisons > D000348 - Aflatoxins

   

(-)-Acanthocarpan

(-)-Acanthocarpan

C17H12O7 (328.0583)


   

Aflatoxin Q1

14-hydroxy-11-methoxy-6,8,19-trioxapentacyclo[10.7.0.0²,⁹.0³,⁷.0¹³,¹⁷]nonadeca-1(12),2(9),4,10,13(17)-pentaene-16,18-dione

C17H12O7 (328.0583)


Aflatoxin Q1 is a mycotoxin. It is a metabolite of Aflatoxin B. It can be found in Aspergillus flavus and Aspergillus parasiticus (Hugo Vanden Bossche, D.W.R. Mackenzie and G. Cauwenbergh. Aspergillus and Aspergillosis, 1987). D009676 - Noxae > D011042 - Poisons > D009183 - Mycotoxins D009676 - Noxae > D011042 - Poisons > D000348 - Aflatoxins

   

2,3-Epoxyaflatoxin B1

(3R,4R,6S,8S)-12-methoxy-5,7,9,20-tetraoxahexacyclo[11.7.0.0^{2,10}.0^{3,8}.0^{4,6}.0^{14,18}]icosa-1(13),2(10),11,14(18)-tetraene-17,19-dione

C17H12O7 (328.0583)


2,3-Epoxyaflatoxin B1 is formed due to the metabolism of aflatoxin B1 (AFB1) by CYP2A13, an enzyme predominantly expressed in the human respiratory tract. There is no detectable AFB1 epoxide formation by CYP2A6, which was also reported to be involved in the metabolic activation of AFB1 (PMID: 16385575). Aflatoxins are naturally occurring mycotoxins that are produced by many species of Aspergillus, a fungus. At least 13 different types of aflatoxin are produced in nature. Aflatoxin B1 is considered the most toxic and is produced by both Aspergillus flavus and Aspergillus parasiticus. The native habitat of Aspergillus is in soil, decaying vegetation, hay, and grains undergoing microbiological deterioration and it invades all types of organic substrates whenever conditions are favourable for its growth. Favourable conditions include high moisture content (at least 7\\%) and high temperature. Aflatoxins B1 (AFB1) are contaminants of improperly stored foods; they are potent genotoxic and carcinogenic compounds, exerting their effects through damage to DNA. They can also induce mutations that increase oxidative damage (PMID: 17214555). Crops which are frequently affected by Aspergillus contamination include cereals (maize, sorghum, pearl millet, rice, wheat), oilseeds (peanut, soybean, sunflower, cotton), spices (chile peppers, black pepper, coriander, turmeric, ginger), and tree nuts (almond, pistachio, walnut, coconut, brazil nut). BioTransformer predicts that 2,3-epoxyaflatoxin B1 is a product of aflatoxin B1 metabolism via an epoxidation-of-vinyl-ether reaction catalyzed by CYP1A2 and CYP3A4 enzymes (PMID: 30612223). D009676 - Noxae > D011042 - Poisons > D009183 - Mycotoxins D009676 - Noxae > D011042 - Poisons > D000348 - Aflatoxins Prob. ultimate carcinogen of Aflatoxin B1 D009676 - Noxae > D002273 - Carcinogens

   

Aflatoxin b1 epoxide

[6AS-(6aa,7ab,8ab,8ba)]-2,3,6a,7a,8a,8b-hexahydro-4-methoxy-cyclopent[c]oxireno[4,5]furo[3,2:4,5]furo[2,3-H][1]benzopyran-1,10-dione

C17H12O7 (328.0583)


   

Aflatoxin G

11-methoxy-6,8,16,20-tetraoxapentacyclo[10.8.0.0²,⁹.0³,⁷.0¹³,¹⁸]icosa-1(12),2(9),4,10,13(18)-pentaene-17,19-dione

C17H12O7 (328.0583)


Aflatoxin G is a mycotoxin produced by Aspergillus flavus and Aspergillus parasiticu D009676 - Noxae > D011042 - Poisons > D009183 - Mycotoxins D009676 - Noxae > D011042 - Poisons > D000348 - Aflatoxins

   

4-[(2-Hydroxy-1-naphthalenyl)azo]benzenesulfonic acid

4-[(Z)-2-(2-Hydroxynaphthalen-1-yl)diazen-1-yl]benzene-1-sulphonic acid

C16H12N2O4S (328.0518)


4-[(2-Hydroxy-1-naphthalenyl)azo]benzenesulfonic acid is a food dye. Banned by the FDA for food use. Food dye. Banned by the FDA for food use

   

Aflatoxin M4

15-hydroxy-11-methoxy-6,8,19-trioxapentacyclo[10.7.0.0²,⁹.0³,⁷.0¹³,¹⁷]nonadeca-1(12),2(9),4,10,13(17)-pentaene-16,18-dione

C17H12O7 (328.0583)


Aflatoxin M4 is a metabolite of Aspergillus flavus and Aspergillus parasiticus (Hugo Vanden Bossche, D.W.R. Mackenzie and G. Cauwenbergh. Aspergillus and Aspergillosis, 1987). Isolated from cultures of Aspergillus parasiticus

   

Cabbage identification factor 2

[3S-(3alpha,3aalpha,5abeta,6alpha,8alpha,9bbeta)]-3a,4,5,5a,6,7,8,9b-Octahydro-6,8-dihydroxy-3,5a,9-trimethylnaphtho[1,2-b]furan-2(3H)-one

C15H12N4O3S (328.063)


Cabbage identification factor 2 is found in brassicas. Cabbage identification factor 2 is an alkaloid found on the leaf surfaces of Brassica oleracea cv. botrytis (cauliflower).

   

3,5-dihydroxy-13,14-dimethoxy-8,17-dioxatetracyclo[8.7.0.0(2),.0(1)(1),(1)]heptadeca-1(10),2,4,6,11,13,15-heptaen-9-one

3,5-dihydroxy-13,14-dimethoxy-8,17-dioxatetracyclo[8.7.0.0(2),.0(1)(1),(1)]heptadeca-1(10),2,4,6,11,13,15-heptaen-9-one

C17H12O7 (328.0583)


   

Rhamnalpinogenin

6,8-dihydroxy-3-methoxy-1-methyl-9,10-dioxo-9,10-dihydroanthracene-2-carboxylic acid

C17H12O7 (328.0583)


Rhamnalpinogenin is a constituent of Crocus sativus (saffron)

   

Orange I

4-[(Z)-2-(4-Hydroxynaphthalen-1-yl)diazen-1-yl]benzene-1-sulphonic acid

C16H12N2O4S (328.0518)


Orange I is formerly used as a food colouring; now banned by the FDA. Formerly used as a food colouring; now banned by the FDA.

   

Sodium 6-hydroxy-5-(phenylazo)-2-naphthalenesulfoniate

(5E)-6-oxo-5-(2-Phenylhydrazin-1-ylidene)-5,6-dihydronaphthalene-2-sulphonic acid

C16H12N2O4S (328.0518)


Sodium 6-hydroxy-5-(phenylazo)-2-naphthalenesulfoniate is a food pigment.

   

Eberconazole

1-{4,6-dichlorotricyclo[9.4.0.0^{3,8}]pentadeca-1(15),3,5,7,11,13-hexaen-2-yl}-1H-imidazole

C18H14Cl2N2 (328.0534)


D - Dermatologicals > D01 - Antifungals for dermatological use > D01A - Antifungals for topical use > D01AC - Imidazole and triazole derivatives C254 - Anti-Infective Agent > C514 - Antifungal Agent

   

5-Formylpratensein

5,7,3-Trihydroxy-4-methoxy-5-formylisoflavone

C17H12O7 (328.0583)


   

Boeravinone E

3,6,9,11-Tetrahydroxy-10-methyl-6a,12a-didehydrorotenone

C17H12O7 (328.0583)


   
   
   

4,2-Epoxy-5,4-dihydroxy-7,5-dimethoxy-3-phenylcoumarin

4,2-Epoxy-5,4-dihydroxy-7,5-dimethoxy-3-phenylcoumarin

C17H12O7 (328.0583)


   

4,2-Epoxy-7,4-dihydroxy-5,5-dimethoxy-3-phenylcoumarin

4,2-Epoxy-7,4-dihydroxy-5,5-dimethoxy-3-phenylcoumarin

C17H12O7 (328.0583)


   

Iriflogenin

3-Methoxyirilone

C17H12O7 (328.0583)


   

Soforanarin A

5,3-Dihydroxy-4-methoxy-6,7-methylenedioxyisoflavone

C17H12O7 (328.0583)


   

6,7-dihydroxy-3-methoxy-4,5-methylenedioxyisoflavone

6,7-dihydroxy-3-methoxy-4,5-methylenedioxyisoflavone

C17H12O7 (328.0583)


   

Dalspinin

3- (1,3-Benzodioxole-5-yl) -5,7-dihydroxy-6-methoxy-4H-1-benzopyran-4-one

C17H12O7 (328.0583)


   

5,3-Dihydroxy-2-methoxy-6,7-methylenedioxyisoflavone

5,3-Dihydroxy-2-methoxy-6,7-methylenedioxyisoflavone

C17H12O7 (328.0583)


   

Kanzakiflavone 1

Kanzakiflavone 1

C17H12O7 (328.0583)


   

Bryaquinone

4-Hydroxy-3,7-dimethoxy-6H-benzofuro [ 3,2-c ] [ 1 ] benzopyran-9,10-dione

C17H12O7 (328.0583)


   
   
   

2,3-Dihydroaustocystin F

2,3-Dihydroaustocystin F

C17H12O7 (328.0583)


   

Quercetin-3-methylaether

Quercetin-3-methylaether

C17H12O7 (328.0583)


   

1,7-dihydroxy-3,9-dimethoxycoumestan|hedysarimcoumestan F

1,7-dihydroxy-3,9-dimethoxycoumestan|hedysarimcoumestan F

C17H12O7 (328.0583)


   

2-Methoxy-3-hydroxy-5-(4-oxo-5,7-dihydroxy-4H-1-benzopyran-3-yl)benzaldehyde

2-Methoxy-3-hydroxy-5-(4-oxo-5,7-dihydroxy-4H-1-benzopyran-3-yl)benzaldehyde

C17H12O7 (328.0583)


   
   

SCHEMBL8976457

SCHEMBL8976457

C17H12O7 (328.0583)


   

DTXSID40782954

DTXSID40782954

C17H12O7 (328.0583)


   

9-O-methyl-10-hydroxycoccineone B

9-O-methyl-10-hydroxycoccineone B

C17H12O7 (328.0583)


   

9,10-Dihydro-3,4,8-trihydroxy-1-methyl-9,10-dioxo-2-anthracenecarboxylic acid methyl ester

9,10-Dihydro-3,4,8-trihydroxy-1-methyl-9,10-dioxo-2-anthracenecarboxylic acid methyl ester

C17H12O7 (328.0583)


   
   

SCHEMBL16226681

SCHEMBL16226681

C17H12O7 (328.0583)


   

2,5,7-Trihydroxyspiro[4H-1-benzopyran-3(2H),5(6H)-cyclobuta[f]-1,3-benzodioxole]-4-one

2,5,7-Trihydroxyspiro[4H-1-benzopyran-3(2H),5(6H)-cyclobuta[f]-1,3-benzodioxole]-4-one

C17H12O7 (328.0583)


   

SCHEMBL16226423

SCHEMBL16226423

C17H12O7 (328.0583)


   

7-Acetylemodin

7-Acetylemodin

C17H12O7 (328.0583)


   

2-Acetyl-1,5,6,8-tetrahydroxy-3-methylanthraquinone

2-Acetyl-1,5,6,8-tetrahydroxy-3-methylanthraquinone

C17H12O7 (328.0583)


   

6-Me ether-3,6,8-Trihydroxy-1-methylanthraquinone-2-carboxylic acid

6-Me ether-3,6,8-Trihydroxy-1-methylanthraquinone-2-carboxylic acid

C17H12O7 (328.0583)


   

6-Methoxybowdichione

6-Methoxybowdichione

C17H12O7 (328.0583)


   

3,5-Dihydroxy-7-methoxy-3,4-(methylenebisoxy)flavone

3,5-Dihydroxy-7-methoxy-3,4-(methylenebisoxy)flavone

C17H12O7 (328.0583)


   

(2S)-5,8,4-trihydroxy-6,7-(vinylenedioxy)flavanone

(2S)-5,8,4-trihydroxy-6,7-(vinylenedioxy)flavanone

C17H12O7 (328.0583)


   

3,8-dihydroxy-6-methoxy-1-methyl-9,10-dioxoanthracene-2-carboxylic acid

3,8-dihydroxy-6-methoxy-1-methyl-9,10-dioxoanthracene-2-carboxylic acid

C17H12O7 (328.0583)


   

5,2-dihydroxy-5-methoxy-6,7-methylenedioxyisoflavone|tetranins B

5,2-dihydroxy-5-methoxy-6,7-methylenedioxyisoflavone|tetranins B

C17H12O7 (328.0583)


   
   
   
   

Ethyl 6-chloro-2-oxo-4-phenyl-chromene-3-carboxylate

Ethyl 6-chloro-2-oxo-4-phenyl-chromene-3-carboxylate

C18H13ClO4 (328.0502)


   

6,9-dihydroxy-7-(3-methoxyphenyl)-8H-[1,3]dioxolo[4,5-g][1]benzopyran-8-one|loasin B

6,9-dihydroxy-7-(3-methoxyphenyl)-8H-[1,3]dioxolo[4,5-g][1]benzopyran-8-one|loasin B

C17H12O7 (328.0583)


   

Boeravinone O

Boeravinone O

C17H12O7 (328.0583)


   

5-methoxy-3?,4?-dihydroxy-6,7-methylenedioxy-4H-1-benzopyran-4-one|iriskashmirianin A

5-methoxy-3?,4?-dihydroxy-6,7-methylenedioxy-4H-1-benzopyran-4-one|iriskashmirianin A

C17H12O7 (328.0583)


   

Cinnalutein

Cinnalutein

C17H12O7 (328.0583)


   

SCHEMBL16226748

SCHEMBL16226748

C17H12O7 (328.0583)


   

5,8-dihydroxy-4-methoxy-6,7-methylenedioxyisoflavone|6,7-Methylene,4-Me ether-4,5,6,7,8-Pentahydroxyisoflavone

5,8-dihydroxy-4-methoxy-6,7-methylenedioxyisoflavone|6,7-Methylene,4-Me ether-4,5,6,7,8-Pentahydroxyisoflavone

C17H12O7 (328.0583)


   

Ventilatone B|ventilatone-B

Ventilatone B|ventilatone-B

C17H12O7 (328.0583)


   

2-O-Demethyldysoanthraquinone

2-O-Demethyldysoanthraquinone

C17H12O7 (328.0583)


   

9,10-Dihydro-3,7,8-trihydroxy-1-methyl-9,10-dioxo-2-anthracenecarboxylic acid methyl ester

9,10-Dihydro-3,7,8-trihydroxy-1-methyl-9,10-dioxo-2-anthracenecarboxylic acid methyl ester

C17H12O7 (328.0583)


   

5-acetyl-2-methoxy-1,4,6-trihydroxy-anthraquinone

5-acetyl-2-methoxy-1,4,6-trihydroxy-anthraquinone

C17H12O7 (328.0583)


   

Oxazepam acetate

2H-1,4-Benzodiazepin-2-one,3-(acetyloxy)-7-chloro-1,3-dihydro-5-phenyl-

C17H13ClN2O3 (328.0615)


   

3,8-Dimethoxy-1,9-dihydroxy-6H-benzofuro[3,2-c][1]benzopyran-6-one

3,8-Dimethoxy-1,9-dihydroxy-6H-benzofuro[3,2-c][1]benzopyran-6-one

C17H12O7 (328.0583)


   

1,8-Dimethoxy-3,9-dihydroxy-6H-benzofuro[3,2-c][1]benzopyran-6-one

1,8-Dimethoxy-3,9-dihydroxy-6H-benzofuro[3,2-c][1]benzopyran-6-one

C17H12O7 (328.0583)


   
   

4,9-dihydroxy-3,8-dimethoxy-benzo[4,5]furo[3,2-c]chromen-6-one|buteaspermin B

4,9-dihydroxy-3,8-dimethoxy-benzo[4,5]furo[3,2-c]chromen-6-one|buteaspermin B

C17H12O7 (328.0583)


   

boeravinoneE

3,6,9,11-Tetrahydroxy-10-methyl[1]benzopyrano[3,4-b][1]benzopyran-12(6H)-one

C17H12O7 (328.0583)


boeravinone E is a natural product found in Mirabilis jalapa with data available.

   

Acid Orange 7 (free acid)

Acid Orange 7 (free acid)

C16H12N2O4S (328.0518)


CONFIDENCE standard compound; INTERNAL_ID 8218

   

AFLATOXIN G1

1H,12H-Furo(3,2:4,5)furo(2,3-h)pyrano(3,4-c)(1)benzopyran-1,12-dione, 3,4,7a,10a-tetrahydro-5-methoxy-, (7aR-cis)-

C17H12O7 (328.0583)


D009676 - Noxae > D011042 - Poisons > D009183 - Mycotoxins D009676 - Noxae > D011042 - Poisons > D000348 - Aflatoxins CONFIDENCE Reference Standard (Level 1)

   

AFLATOXIN M1

AFLATOXIN M1

C17H12O7 (328.0583)


A member of the class of aflatoxins that is aflatoxin B1 in which the hydrogen at position 9a is replaced by a hydroxy group. D009676 - Noxae > D011042 - Poisons > D009183 - Mycotoxins D009676 - Noxae > D011042 - Poisons > D000348 - Aflatoxins CONFIDENCE Reference Standard (Level 1)

   

Aflatoxin

AFLATOXIN G1

C17H12O7 (328.0583)


D009676 - Noxae > D011042 - Poisons > D009183 - Mycotoxins D009676 - Noxae > D011042 - Poisons > D000348 - Aflatoxins CONFIDENCE standard compound; INTERNAL_ID 5964

   

Asp-Ser-OH

(S)-2-(3-(carboxymethoxy)-4-nitrobenzamido)-4-hydroxybutanoic acid

C12H12N2O9 (328.0543)


   

Rhamnalpinogenin

6,8-dihydroxy-3-methoxy-1-methyl-9,10-dioxo-9,10-dihydroanthracene-2-carboxylic acid

C17H12O7 (328.0583)


   

Cabbage identification factor 2

2-{5-thia-2,7,16-triazatetracyclo[7.7.0.0^{2,6}.0^{10,15}]hexadeca-1(16),6,8,10,12,14-hexaen-3-ylformamido}acetic acid

C15H12N4O3S (328.063)


   

Orange II

4-[(Z)-2-(2-hydroxynaphthalen-1-yl)diazen-1-yl]benzene-1-sulfonic acid

C16H12N2O4S (328.0518)


   

Aflatoxin M4

15-hydroxy-11-methoxy-6,8,19-trioxapentacyclo[10.7.0.0^{2,9}.0^{3,7}.0^{13,17}]nonadeca-1,4,9,11,13(17)-pentaene-16,18-dione

C17H12O7 (328.0583)


   

Magnesium bis(4-amino-2-hydroxybenzoate)

Magnesium bis(4-amino-2-hydroxybenzoate)

C14H12MgN2O6 (328.0546)


   

4-[(8-QUINOLINYLSULFONYL)AMINO]BENZOIC ACID

4-[(8-QUINOLINYLSULFONYL)AMINO]BENZOIC ACID

C16H12N2O4S (328.0518)


   
   

TETRAAMMINEPALLADIUM(II) ACETATE

TETRAAMMINEPALLADIUM(II) ACETATE

C4H22N4O6Pd (328.0574)


   

ETHYL 3-(3,5-BIS(TRIFLUOROMETHYL)PHENYL)-3-OXOPROPANOATE

ETHYL 3-(3,5-BIS(TRIFLUOROMETHYL)PHENYL)-3-OXOPROPANOATE

C13H10F6O3 (328.0534)


   

Aflatoxin G1-13C17

Aflatoxin G1-13C17

C17H12O7 (328.0583)


   

clorexolone

clorexolone

C14H17ClN2O3S (328.0648)


C - Cardiovascular system > C03 - Diuretics > C03B - Low-ceiling diuretics, excl. thiazides > C03BA - Sulfonamides, plain C78275 - Agent Affecting Blood or Body Fluid > C448 - Diuretic

   
   

2-(Piperazin-1-yl)acetic acid N-(3-pyridyl)amidetrihydrochloride

2-(Piperazin-1-yl)acetic acid N-(3-pyridyl)amidetrihydrochloride

C11H19Cl3N4O (328.0624)


   

4,6-dichloro-1-(1,4-dioxaspiro[4.5]decan-8-yl)-1H-pyrazolo[3,4-d]pyrimidine

4,6-dichloro-1-(1,4-dioxaspiro[4.5]decan-8-yl)-1H-pyrazolo[3,4-d]pyrimidine

C13H14Cl2N4O2 (328.0494)


   

C.I. acid orange 12

(5E)-6-Oxo-5-(phenylhydrazono)-5,6-dihydro-2-naphthalenesulfonic acid

C16H12N2O4S (328.0518)


   

HydroxyMethylclenbuterol hydrochloride

HydroxyMethylclenbuterol hydrochloride

C12H19Cl3N2O2 (328.0512)


   

2,3-Dihydroxypropyl 5-deoxy-5-(dimethylarsinyl)-beta-D-Ribofuranoside

2,3-Dihydroxypropyl 5-deoxy-5-(dimethylarsinyl)-beta-D-Ribofuranoside

C10H21AsO7 (328.0503)


   

Benzenesulfonic acid, 4-((4-hydroxy-1-naphthalenyl)azo)-

Benzenesulfonic acid, 4-((4-hydroxy-1-naphthalenyl)azo)-

C16H12N2O4S (328.0518)


   

2,3,6a,9a-Tetrahydro-3-hydroxy-4-methoxycyclopenta(c)furo(3,2:4,5)furo(2,3-h)(1)benzopyran-1,11-dione

2,3,6a,9a-Tetrahydro-3-hydroxy-4-methoxycyclopenta(c)furo(3,2:4,5)furo(2,3-h)(1)benzopyran-1,11-dione

C17H12O7 (328.0583)


   

4-[(1,4-Dioxo-2-naphthalenyl)amino]benzenesulfonamide

4-[(1,4-Dioxo-2-naphthalenyl)amino]benzenesulfonamide

C16H12N2O4S (328.0518)


   

3-[5-[Oxo-(3-pyridinylamino)methyl]-2-furanyl]-2-thiophenecarboxylic acid methyl ester

3-[5-[Oxo-(3-pyridinylamino)methyl]-2-furanyl]-2-thiophenecarboxylic acid methyl ester

C16H12N2O4S (328.0518)


   

N-phenylcarbamic acid [5-(2-chlorophenyl)-3-isoxazolyl]methyl ester

N-phenylcarbamic acid [5-(2-chlorophenyl)-3-isoxazolyl]methyl ester

C17H13ClN2O3 (328.0615)


   

Eberconazole

Eberconazole

C18H14Cl2N2 (328.0534)


D - Dermatologicals > D01 - Antifungals for dermatological use > D01A - Antifungals for topical use > D01AC - Imidazole and triazole derivatives C254 - Anti-Infective Agent > C514 - Antifungal Agent

   
   

Benzimidazole ribotide phosphate

Benzimidazole ribotide phosphate

C12H13N2O7P-2 (328.046)


   

Tubercidin 3,5-cyclic phosphate

Tubercidin 3,5-cyclic phosphate

C11H13N4O6P (328.0573)


   

2-[2-(2-Oxo-benzothiazol-3-yl)-acetylamino]-benzoic acid

2-[2-(2-Oxo-benzothiazol-3-yl)-acetylamino]-benzoic acid

C16H12N2O4S (328.0518)


   

3-(2,2-dichlorovinyl)-N-(2-fluorobenzylidene)-2,2-dimethylcyclopropanecarbohydrazide

3-(2,2-dichlorovinyl)-N-(2-fluorobenzylidene)-2,2-dimethylcyclopropanecarbohydrazide

C15H15Cl2FN2O (328.0545)


   

4-[2-(1,3-Benzodioxol-5-ylamino)-4-thiazolyl]benzene-1,3-diol

4-[2-(1,3-Benzodioxol-5-ylamino)-4-thiazolyl]benzene-1,3-diol

C16H12N2O4S (328.0518)


   
   
   

Quercetin 3,4-dimethyl ether

Quercetin 3,4-dimethyl ether

C17H12O7-2 (328.0583)


   

5-(4-Chlorophenyl)-4-(4-methylbenzoyl)oxolane-2,3-dione

5-(4-Chlorophenyl)-4-(4-methylbenzoyl)oxolane-2,3-dione

C18H13ClO4 (328.0502)


   

(2Z)-2-[[4-(trifluoromethyl)anilino]methylidene]-7,7a-dihydro-6H-pyrrolo[2,1-b][1,3]thiazole-3,5-dione

(2Z)-2-[[4-(trifluoromethyl)anilino]methylidene]-7,7a-dihydro-6H-pyrrolo[2,1-b][1,3]thiazole-3,5-dione

C14H11F3N2O2S (328.0493)


   

4-(7-Methoxy-2-oxochromen-6-yl)butan-2-yl hydrogen sulate

4-(7-Methoxy-2-oxochromen-6-yl)butan-2-yl hydrogen sulate

C14H16O7S (328.0617)


   

(5Z)-3-(3,4-dihydroxyphenyl)-5-[(3,4-dihydroxyphenyl)methylidene]-4-hydroxyfuran-2-one

(5Z)-3-(3,4-dihydroxyphenyl)-5-[(3,4-dihydroxyphenyl)methylidene]-4-hydroxyfuran-2-one

C17H12O7 (328.0583)


   

Aflatoxin Q1

Aflatoxin Q1

C17H12O7 (328.0583)


A member of the class of aflatoxins that is aflatoxin B1 in which the hydrogen at the pro-3S position is replaced by a hydroxy group. D009676 - Noxae > D011042 - Poisons > D009183 - Mycotoxins D009676 - Noxae > D011042 - Poisons > D000348 - Aflatoxins

   

2,3-Epoxyaflatoxin B1

aflatoxin B1 exo-8,9-epoxide

C17H12O7 (328.0583)


D009676 - Noxae > D011042 - Poisons > D009183 - Mycotoxins D009676 - Noxae > D011042 - Poisons > D000348 - Aflatoxins D009676 - Noxae > D002273 - Carcinogens

   

Aflatoxin B1 endo-8,9-epoxide

Aflatoxin B1 endo-8,9-epoxide

C17H12O7 (328.0583)


   

4-((2-Hydroxy-1-naphthyl)azo)benzenesulphonic acid

4-((2-Hydroxy-1-naphthyl)azo)benzenesulphonic acid

C16H12N2O4S (328.0518)


   

aflatoxin B1 endo-8,9-oxide

aflatoxin B1 endo-8,9-oxide

C17H12O7 (328.0583)


A member of the class of aflatoxins that is obtained by the formal epoxidation across the 8,9-double bond of aflatoxin B1.

   

aflatoxin B1 exo-8,9-epoxide

aflatoxin B1 exo-8,9-epoxide

C17H12O7 (328.0583)


   
   

ERK-IN-4

ERK-IN-4

C14H17ClN2O3S (328.0648)


ERK-IN-4 is an ERK inhibitor binds preferentially to ERK2 with a Kd of 5 μM. ERK-IN-4 specificity inhibits ERK Rsk-1 and Elk-1 phosphorylation. ERK-IN-4 has little effect on ERK protein phosphorylation by its upstream activator MEK1/2[1].

   

1,3,6-trihydroxy-2-methoxy-10h-5,11-dioxatetraphen-12-one

1,3,6-trihydroxy-2-methoxy-10h-5,11-dioxatetraphen-12-one

C17H12O7 (328.0583)


   

9-hydroxy-7-(4-hydroxy-3-methoxyphenyl)-2h-[1,3]dioxolo[4,5-g]chromen-8-one

9-hydroxy-7-(4-hydroxy-3-methoxyphenyl)-2h-[1,3]dioxolo[4,5-g]chromen-8-one

C17H12O7 (328.0583)


   

methyl 3,4,8-trihydroxy-1-methyl-9,10-dioxoanthracene-2-carboxylate

methyl 3,4,8-trihydroxy-1-methyl-9,10-dioxoanthracene-2-carboxylate

C17H12O7 (328.0583)


   

2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-methoxynaphthalene-1,4-dione

2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-methoxynaphthalene-1,4-dione

C17H12O7 (328.0583)


   

2-(2h-1,3-benzodioxol-5-yl)-3,5-dihydroxy-7-methoxychromen-4-one

2-(2h-1,3-benzodioxol-5-yl)-3,5-dihydroxy-7-methoxychromen-4-one

C17H12O7 (328.0583)


   

1,8-dihydroxy-6-methoxy-3-methyl-9,10-dioxoanthracene-2-carboxylic acid

1,8-dihydroxy-6-methoxy-3-methyl-9,10-dioxoanthracene-2-carboxylic acid

C17H12O7 (328.0583)


   

2,5,7-trihydroxy-2h-9',11'-dioxaspiro[1-benzopyran-3,4'-tricyclo[6.3.0.0³,⁶]undecane]-1'(8'),2',6'-trien-4-one

2,5,7-trihydroxy-2h-9',11'-dioxaspiro[1-benzopyran-3,4'-tricyclo[6.3.0.0³,⁶]undecane]-1'(8'),2',6'-trien-4-one

C17H12O7 (328.0583)


   

2',3'-dihydroxypropyl [5-deoxy-5-(demethylarsinyl)]ribofuranoside

NA

C10H21AsO7 (328.0503)


{"Ingredient_id": "HBIN004054","Ingredient_name": "2',3'-dihydroxypropyl [5-deoxy-5-(demethylarsinyl)]ribofuranoside","Alias": "NA","Ingredient_formula": "C10H21AsO7","Ingredient_Smile": "NA","Ingredient_weight": "328.19","OB_score": "NA","CAS_id": "103476-61-5","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "8934","PubChem_id": "NA","DrugBank_id": "NA"}

   

aflatoxin g1

NA

C17H12O7 (328.0583)


{"Ingredient_id": "HBIN014778","Ingredient_name": "aflatoxin g1","Alias": "NA","Ingredient_formula": "C17H12O7","Ingredient_Smile": "COC1=C2C3=C(C(=O)OCC3)C(=O)OC2=C4C5C=COC5OC4=C1","Ingredient_weight": "328.27 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "673","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "15939117","DrugBank_id": "NA"}

   

5-(5,7-dihydroxy-4-oxochromen-2-yl)-2-hydroxyphenyl acetate

5-(5,7-dihydroxy-4-oxochromen-2-yl)-2-hydroxyphenyl acetate

C17H12O7 (328.0583)


   

3,12-dihydroxy-5,14-dimethoxy-8,17-dioxatetracyclo[8.7.0.0²,⁷.0¹¹,¹⁶]heptadeca-1(10),2(7),3,5,11(16),12,14-heptaen-9-one

3,12-dihydroxy-5,14-dimethoxy-8,17-dioxatetracyclo[8.7.0.0²,⁷.0¹¹,¹⁶]heptadeca-1(10),2(7),3,5,11(16),12,14-heptaen-9-one

C17H12O7 (328.0583)


   

ethyl 7-chloro-2-oxo-4-phenylchromene-3-carboxylate

ethyl 7-chloro-2-oxo-4-phenylchromene-3-carboxylate

C18H13ClO4 (328.0502)


   

methyl 3,6,8-trihydroxy-1-methyl-9,10-dioxoanthracene-2-carboxylate

methyl 3,6,8-trihydroxy-1-methyl-9,10-dioxoanthracene-2-carboxylate

C17H12O7 (328.0583)


   

(4,5,7-trihydroxy-9,10-dioxoanthracen-2-yl)methyl acetate

(4,5,7-trihydroxy-9,10-dioxoanthracen-2-yl)methyl acetate

C17H12O7 (328.0583)


   

5'-(hydroxymethyl)-5'-(methylsulfanyl)-7,7a-dihydro-3h-spiro[1-benzothiophene-2,2'-pyrazine]-3',6',7-triol

5'-(hydroxymethyl)-5'-(methylsulfanyl)-7,7a-dihydro-3h-spiro[1-benzothiophene-2,2'-pyrazine]-3',6',7-triol

C13H16N2O4S2 (328.0551)


   

1,6-dihydroxy-8-methoxy-3-methyl-9,10-dioxoanthracene-2-carboxylic acid

1,6-dihydroxy-8-methoxy-3-methyl-9,10-dioxoanthracene-2-carboxylic acid

C17H12O7 (328.0583)


   

[5'-(but-3-en-1-yn-1-yl)-[2,2'-bithiophen]-5-yl]methyl (2e)-2-methylbut-2-enoate

[5'-(but-3-en-1-yn-1-yl)-[2,2'-bithiophen]-5-yl]methyl (2e)-2-methylbut-2-enoate

C18H16O2S2 (328.0592)


   

3,5-dihydroxy-13,14-dimethoxy-8,17-dioxatetracyclo[8.7.0.0²,⁷.0¹¹,¹⁶]heptadeca-1(10),2(7),3,5,11(16),12,14-heptaen-9-one

3,5-dihydroxy-13,14-dimethoxy-8,17-dioxatetracyclo[8.7.0.0²,⁷.0¹¹,¹⁶]heptadeca-1(10),2(7),3,5,11(16),12,14-heptaen-9-one

C17H12O7 (328.0583)


   

(1s)-6,8,11,17,19,23-hexaoxahexacyclo[11.10.0.0²,¹⁰.0⁵,⁹.0¹⁴,²².0¹⁶,²⁰]tricosa-2(10),3,5(9),14,16(20),21-hexaen-13-ol

(1s)-6,8,11,17,19,23-hexaoxahexacyclo[11.10.0.0²,¹⁰.0⁵,⁹.0¹⁴,²².0¹⁶,²⁰]tricosa-2(10),3,5(9),14,16(20),21-hexaen-13-ol

C17H12O7 (328.0583)


   

5-(5,7-dihydroxy-4-oxochromen-3-yl)-3-hydroxy-2-methoxybenzaldehyde

5-(5,7-dihydroxy-4-oxochromen-3-yl)-3-hydroxy-2-methoxybenzaldehyde

C17H12O7 (328.0583)


   

14-hydroxy-11-methoxy-6,8,19-trioxapentacyclo[10.7.0.0²,⁹.0³,⁷.0¹³,¹⁷]nonadeca-1,4,9,11,13(17)-pentaene-16,18-dione

14-hydroxy-11-methoxy-6,8,19-trioxapentacyclo[10.7.0.0²,⁹.0³,⁷.0¹³,¹⁷]nonadeca-1,4,9,11,13(17)-pentaene-16,18-dione

C17H12O7 (328.0583)


   

2-(7-hydroxy-6-methoxy-4-oxochromen-3-yl)-5-methoxycyclohexa-2,5-diene-1,4-dione

2-(7-hydroxy-6-methoxy-4-oxochromen-3-yl)-5-methoxycyclohexa-2,5-diene-1,4-dione

C17H12O7 (328.0583)


   

1,3,8-trihydroxy-6-(1-hydroxy-2-oxopropyl)anthracene-9,10-dione

1,3,8-trihydroxy-6-(1-hydroxy-2-oxopropyl)anthracene-9,10-dione

C17H12O7 (328.0583)


   

(2r,3r,4s,5s)-2-[(2r)-2,3-dihydroxypropoxy]-5-[(dimethylarsoryl)methyl]oxolane-3,4-diol

(2r,3r,4s,5s)-2-[(2r)-2,3-dihydroxypropoxy]-5-[(dimethylarsoryl)methyl]oxolane-3,4-diol

C10H21AsO7 (328.0503)


   

methyl 3,7,8-trihydroxy-1-methyl-9,10-dioxoanthracene-2-carboxylate

methyl 3,7,8-trihydroxy-1-methyl-9,10-dioxoanthracene-2-carboxylate

C17H12O7 (328.0583)


   

(3e,5e)-6-(2,6-dichloro-3,5-dimethoxyphenyl)-4-methylhepta-3,5-dien-2-one

(3e,5e)-6-(2,6-dichloro-3,5-dimethoxyphenyl)-4-methylhepta-3,5-dien-2-one

C16H18Cl2O3 (328.0633)


   

[5'-(but-3-en-1-yn-1-yl)-[2,2'-bithiophen]-5-yl]methyl (2z)-2-methylbut-2-enoate

[5'-(but-3-en-1-yn-1-yl)-[2,2'-bithiophen]-5-yl]methyl (2z)-2-methylbut-2-enoate

C18H16O2S2 (328.0592)


   

3,14-dihydroxy-5,13-dimethoxy-8,17-dioxatetracyclo[8.7.0.0²,⁷.0¹¹,¹⁶]heptadeca-1(10),2(7),3,5,11(16),12,14-heptaen-9-one

3,14-dihydroxy-5,13-dimethoxy-8,17-dioxatetracyclo[8.7.0.0²,⁷.0¹¹,¹⁶]heptadeca-1(10),2(7),3,5,11(16),12,14-heptaen-9-one

C17H12O7 (328.0583)


   

7-hydroxy-6,8-dimethoxy-9,10-dioxoanthracene-2-carboxylic acid

7-hydroxy-6,8-dimethoxy-9,10-dioxoanthracene-2-carboxylic acid

C17H12O7 (328.0583)


   

[5'-(but-3-en-1-yn-1-yl)-[2,2'-bithiophen]-5-yl]methyl 2-methylbut-2-enoate

[5'-(but-3-en-1-yn-1-yl)-[2,2'-bithiophen]-5-yl]methyl 2-methylbut-2-enoate

C18H16O2S2 (328.0592)


   

(3r,7s)-11-methoxy-6,8,16,20-tetraoxapentacyclo[10.8.0.0²,⁹.0³,⁷.0¹³,¹⁸]icosa-1,4,9,11,13(18)-pentaene-17,19-dione

(3r,7s)-11-methoxy-6,8,16,20-tetraoxapentacyclo[10.8.0.0²,⁹.0³,⁷.0¹³,¹⁸]icosa-1,4,9,11,13(18)-pentaene-17,19-dione

C17H12O7 (328.0583)


   

ethyl 6-chloro-2-oxo-4-phenylchromene-3-carboxylate

ethyl 6-chloro-2-oxo-4-phenylchromene-3-carboxylate

C18H13ClO4 (328.0502)


   

3,6,9,11-tetrahydroxy-10-methyl-6h-5,7-dioxatetraphen-12-one

3,6,9,11-tetrahydroxy-10-methyl-6h-5,7-dioxatetraphen-12-one

C17H12O7 (328.0583)


   

2-(2,3-dihydroxypropoxy)-5-[(dimethylarsoryl)methyl]oxolane-3,4-diol

2-(2,3-dihydroxypropoxy)-5-[(dimethylarsoryl)methyl]oxolane-3,4-diol

C10H21AsO7 (328.0503)


   

9-hydroxy-7-(2-hydroxy-5-methoxyphenyl)-2h-[1,3]dioxolo[4,5-g]chromen-8-one

9-hydroxy-7-(2-hydroxy-5-methoxyphenyl)-2h-[1,3]dioxolo[4,5-g]chromen-8-one

C17H12O7 (328.0583)


   

(2r,5'r,7s,7as)-5'-(hydroxymethyl)-5'-(methylsulfanyl)-7,7a-dihydro-3h-spiro[1-benzothiophene-2,2'-pyrazine]-3',6',7-triol

(2r,5'r,7s,7as)-5'-(hydroxymethyl)-5'-(methylsulfanyl)-7,7a-dihydro-3h-spiro[1-benzothiophene-2,2'-pyrazine]-3',6',7-triol

C13H16N2O4S2 (328.0551)


   

5,14-dihydroxy-3,13-dimethoxy-8,17-dioxatetracyclo[8.7.0.0²,⁷.0¹¹,¹⁶]heptadeca-1(10),2(7),3,5,11(16),12,14-heptaen-9-one

5,14-dihydroxy-3,13-dimethoxy-8,17-dioxatetracyclo[8.7.0.0²,⁷.0¹¹,¹⁶]heptadeca-1(10),2(7),3,5,11(16),12,14-heptaen-9-one

C17H12O7 (328.0583)


   

6,7-dihydroxy-2-(7-methoxy-2h-1,3-benzodioxol-5-yl)chromen-4-one

6,7-dihydroxy-2-(7-methoxy-2h-1,3-benzodioxol-5-yl)chromen-4-one

C17H12O7 (328.0583)


   

4,9-dihydroxy-7-(4-methoxyphenyl)-2h-[1,3]dioxolo[4,5-g]chromen-8-one

4,9-dihydroxy-7-(4-methoxyphenyl)-2h-[1,3]dioxolo[4,5-g]chromen-8-one

C17H12O7 (328.0583)


   

9-hydroxy-7-(3-hydroxy-4-methoxyphenyl)-2h-[1,3]dioxolo[4,5-g]chromen-8-one

9-hydroxy-7-(3-hydroxy-4-methoxyphenyl)-2h-[1,3]dioxolo[4,5-g]chromen-8-one

C17H12O7 (328.0583)


   

6,14-dihydroxy-5,13-dimethoxy-8,17-dioxatetracyclo[8.7.0.0²,⁷.0¹¹,¹⁶]heptadeca-1(10),2(7),3,5,11(16),12,14-heptaen-9-one

6,14-dihydroxy-5,13-dimethoxy-8,17-dioxatetracyclo[8.7.0.0²,⁷.0¹¹,¹⁶]heptadeca-1(10),2(7),3,5,11(16),12,14-heptaen-9-one

C17H12O7 (328.0583)


   

[5'-(but-3-en-1-yn-1-yl)-[2,2'-bithiophen]-5-yl]methyl 3-methylbut-2-enoate

[5'-(but-3-en-1-yn-1-yl)-[2,2'-bithiophen]-5-yl]methyl 3-methylbut-2-enoate

C18H16O2S2 (328.0592)


   

6,7-dihydroxy-3-(7-methoxy-2h-1,3-benzodioxol-5-yl)chromen-4-one

6,7-dihydroxy-3-(7-methoxy-2h-1,3-benzodioxol-5-yl)chromen-4-one

C17H12O7 (328.0583)


   

(12s)-2,9-dihydroxy-12-(4-hydroxyphenyl)-4,7,11-trioxatricyclo[8.4.0.0³,⁸]tetradeca-1,3(8),5,9-tetraen-14-one

(12s)-2,9-dihydroxy-12-(4-hydroxyphenyl)-4,7,11-trioxatricyclo[8.4.0.0³,⁸]tetradeca-1,3(8),5,9-tetraen-14-one

C17H12O7 (328.0583)


   

(11s)-8-hydroxy-5-methoxy-11-methyl-12,16-dioxatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1,4,7,9(17),13-pentaene-3,6,15-trione

(11s)-8-hydroxy-5-methoxy-11-methyl-12,16-dioxatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1,4,7,9(17),13-pentaene-3,6,15-trione

C17H12O7 (328.0583)


   

1,6,8-trihydroxy-3-methyl-9,10-dioxoanthracen-2-yl acetate

1,6,8-trihydroxy-3-methyl-9,10-dioxoanthracen-2-yl acetate

C17H12O7 (328.0583)


   

5-acetyl-1,4,6-trihydroxy-2-methoxyanthracene-9,10-dione

5-acetyl-1,4,6-trihydroxy-2-methoxyanthracene-9,10-dione

C17H12O7 (328.0583)


   

8-hydroxy-5-methoxy-11-methyl-12,16-dioxatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1,4,7,9(17),13-pentaene-3,6,15-trione

8-hydroxy-5-methoxy-11-methyl-12,16-dioxatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1,4,7,9(17),13-pentaene-3,6,15-trione

C17H12O7 (328.0583)


   

9-hydroxy-7-(3-hydroxy-2-methoxyphenyl)-2h-[1,3]dioxolo[4,5-g]chromen-8-one

9-hydroxy-7-(3-hydroxy-2-methoxyphenyl)-2h-[1,3]dioxolo[4,5-g]chromen-8-one

C17H12O7 (328.0583)


   

(2r,3r)-2,5,7-trihydroxy-2h-9',11'-dioxaspiro[1-benzopyran-3,4'-tricyclo[6.3.0.0³,⁶]undecane]-1'(8'),2',6'-trien-4-one

(2r,3r)-2,5,7-trihydroxy-2h-9',11'-dioxaspiro[1-benzopyran-3,4'-tricyclo[6.3.0.0³,⁶]undecane]-1'(8'),2',6'-trien-4-one

C17H12O7 (328.0583)