Chemical Formula: C9H9NO5

Chemical Formula C9H9NO5

Found 74 metabolite its formula value is C9H9NO5

2,4-Dihydroxy-7-methoxy-2H-1,4-benzoxazin-3(4H)-one

DIMBOA pound>>2,4-Dihydroxy-7-methoxy-1,4-benzoxazinone;2,4-Dihydroxy-7-methoxy-2H-1,4-benzoxazin-3(4H)-one

C9H9NO5 (211.04807040000003)


DIMBOA is a lactol that is DIBOA in which the hydrogen at position 7 is replaced by a methoxy group. It has been isolated from the maize plants. It has a role as a plant metabolite and an allelochemical. It is a lactol, a benzoxazine, an aromatic ether and a cyclic hydroxamic acid. It is functionally related to a DIBOA. 2,4-Dihydroxy-7-methoxy-1,4-benzoxazin-3-one is a natural product found in Trichoderma virens with data available. 2,4-Dihydroxy-7-methoxy-2H-1,4-benzoxazin-3(4H)-one is found in cereals and cereal products. 2,4-Dihydroxy-7-methoxy-2H-1,4-benzoxazin-3(4H)-one is isolated from wheat, in which it is present mainly as glucoside. Appears to be a natural aphicide, insecticide and fungicide. Involved in the in vivo detoxification of herbicides , e.g. Simazin Isolated from wheat, in which it is present mainly as glucoside. Appears to be a natural aphicide, insecticide and fungicide. Involved in the in vivo detoxification of herbicides , e.g. Simazine. (R)-2,4-Dihydroxy-7-methoxy-2H-1,4-benzoxazin-3(4H)-one is found in cereals and cereal products and corn. A lactol that is DIBOA in which the hydrogen at position 7 is replaced by a methoxy group. It has been isolated from the maize plants. DIMBOA, an antibiotic, is a benzoxazinoid, part of the chemical defense system of graminaceous plants such as maize, wheat, and rye. DIMBOA possess growth inhibitory properties against many strains of studied bacteria and fungi, such as Staphylococcus aureus, Escherichia coli as well as against Saccharomyces cerevisiae. DIMBOA exhibits a potent free-radical scavenging activity and a weaker iron (III) ions reducing activity. Antioxidant activity[1][2].

   

5-(2-Formylethyl)-4,6-dihydroxypicolinate

5-(β-Formylethyl)-4,6-dihydroxypicolinate

C9H9NO5 (211.04807040000003)


   

Betalamic acid

(4Z)-4-(2-oxoethylidene)-1,2,3,4-tetrahydropyridine-2,6-dicarboxylic acid

C9H9NO5 (211.04807040000003)


Betalamic acid is found in common beet. Betalamic acid is a precursor of betalains pigments in plants of the Centrospermae. Betalamic acid is detected in Beta vulgaris (beetroot Precursor of betalains pigments in plants of the Centrospermae. Detected in Beta vulgaris (beetroot). Betalamic acid is found in red beetroot, common beet, and root vegetables. D004396 - Coloring Agents > D050858 - Betalains

   
   

Topaquinone

(2S)-2-amino-3-(6-hydroxy-3,4-dioxocyclohexa-1,5-dien-1-yl)propanoic acid

C9H9NO5 (211.04807040000003)


Topaquinone (TPQ), is the quinone of 2,4,5-trihydroxyphenylalanine. TPQ is the cofactor in most copper-containing amine oxidases. It is produced by post-translational modification of a strictly conserved active-site tyrosine residue with the participation of the copper ion at the active site. Once formed, TPQ acts as a switch between the heterolytic transformation of amine substrates to aldehydes, via a pyridoxal phosphate-like Schiff base complex, and one electron chemistry involving reduction of molecular oxygen (PMID: 12686122) [HMDB] Topaquinone (TPQ), is the quinone of 2,4,5-trihydroxyphenylalanine. TPQ is the cofactor in most copper-containing amine oxidases. It is produced by post-translational modification of a strictly conserved active-site tyrosine residue with the participation of the copper ion at the active site. Once formed, TPQ acts as a switch between the heterolytic transformation of amine substrates to aldehydes, via a pyridoxal phosphate-like Schiff base complex, and one electron chemistry involving reduction of molecular oxygen (PMID: 12686122).

   

Gentisuric acid

2-{[(2,5-dihydroxyphenyl)(hydroxy)methylidene]amino}acetate

C9H9NO5 (211.04807040000003)


Gentisuric acid is a metabolite of aspirin in man. Gentisuric acid was synthesized from gentisic acid and glycine ethyl ester. (PMID: 417892) D000893 - Anti-Inflammatory Agents > D000894 - Anti-Inflammatory Agents, Non-Steroidal > D012459 - Salicylates

   

2-Amino-3-(2,4,5-trihydroxyphenyl)prop-2-enoic acid

2-Amino-3-(2,4,5-trihydroxyphenyl)prop-2-enoic acid

C9H9NO5 (211.04807040000003)


   
   
   

5-[amino(carboxy)methyl]-2-hydroxybenzoic acid

5-[amino(carboxy)methyl]-2-hydroxybenzoic acid

C9H9NO5 (211.04807040000003)


   

4-formyl-2,3-dihydro-1H-azepine-2,7-dicarboxylic acid|Muscaflavin

4-formyl-2,3-dihydro-1H-azepine-2,7-dicarboxylic acid|Muscaflavin

C9H9NO5 (211.04807040000003)


   

DIMBOA

DIMBOA

C9H9NO5 (211.04807040000003)


Annotation level-3

   

Topaquinone

alpha-Amino-6-hydroxy-3,4-dioxo-(as)-1,5-cyclohexadiene-1-propanoic acid

C9H9NO5 (211.04807040000003)


   

1-(4,5-Methylenedioxy-2-Nitrophenol)Ethan-2-OL

1-(4,5-Methylenedioxy-2-Nitrophenol)Ethan-2-OL

C9H9NO5 (211.04807040000003)


   

ethyl 4-hydroxy-3-nitrobenzoate

ethyl 4-hydroxy-3-nitrobenzoate

C9H9NO5 (211.04807040000003)


   

3,4-Dimethoxy-5-nitrobenzaldehyde

3,4-Dimethoxy-5-nitrobenzaldehyde

C9H9NO5 (211.04807040000003)


   

Propanoic acid,2-(2-nitrophenoxy)-

Propanoic acid,2-(2-nitrophenoxy)-

C9H9NO5 (211.04807040000003)


   

2,3-dimethoxy-5-nitro-benzaldehyde

2,3-dimethoxy-5-nitro-benzaldehyde

C9H9NO5 (211.04807040000003)


   

Ethyl 3-hydroxy-4-nitrobenzoate

Ethyl 3-hydroxy-4-nitrobenzoate

C9H9NO5 (211.04807040000003)


   

Benzaldehyde,3,6-dimethoxy-2-nitro-

Benzaldehyde,3,6-dimethoxy-2-nitro-

C9H9NO5 (211.04807040000003)


   

BENZENEACETIC ACID, 3-METHOXY-2-NITRO-

BENZENEACETIC ACID, 3-METHOXY-2-NITRO-

C9H9NO5 (211.04807040000003)


   

methyl3-methoxy-4-nitrobenzoate

methyl3-methoxy-4-nitrobenzoate

C9H9NO5 (211.04807040000003)


   

Methyl 5-methoxy-2-nitrobenzoate

Methyl 5-methoxy-2-nitrobenzoate

C9H9NO5 (211.04807040000003)


   

methyl 4-(hydroxymethyl)-3-nitrobenzoate

methyl 4-(hydroxymethyl)-3-nitrobenzoate

C9H9NO5 (211.04807040000003)


   

Methyl 2-methoxy-4-nitrobenzoate

Methyl 2-methoxy-4-nitrobenzoate

C9H9NO5 (211.04807040000003)


   

5-(Methoxymethyl)-2,3-pyridinedicarboxylic acid

5-(Methoxymethyl)-2,3-pyridinedicarboxylic acid

C9H9NO5 (211.04807040000003)


   

Methyl 4-methoxy-3-nitrobenzoate

Methyl 4-methoxy-3-nitrobenzoate

C9H9NO5 (211.04807040000003)


   

3-(4-nitrophenyl)propanoic acid

3-(4-nitrophenyl)propanoic acid

C9H9NO5 (211.04807040000003)


   
   
   

2-Ethoxy-4-formyl-6-nitrophenol

2-Ethoxy-4-formyl-6-nitrophenol

C9H9NO5 (211.04807040000003)


   

2-(4-Nitrophenoxy)propanoic acid

2-(4-Nitrophenoxy)propanoic acid

C9H9NO5 (211.04807040000003)


   

Benzoic acid, 3-ethoxy-4-nitro- (9CI)

Benzoic acid, 3-ethoxy-4-nitro- (9CI)

C9H9NO5 (211.04807040000003)


   

Methyl 4-methoxy-2-nitrobenzoate

Methyl 4-methoxy-2-nitrobenzoate

C9H9NO5 (211.04807040000003)


   

(S)-3-BOC-AMINO-1-DIAZO-3-(4-BENZYLOXY)PHENYL-2-BUTANONE

(S)-3-BOC-AMINO-1-DIAZO-3-(4-BENZYLOXY)PHENYL-2-BUTANONE

C9H9NO5 (211.04807040000003)


   

Ethyl 4-hydroxy-2-nitrobenzoate

Ethyl 4-hydroxy-2-nitrobenzoate

C9H9NO5 (211.04807040000003)


   

(3-Methoxy-4-nitro-phenyl)-acetic acid

(3-Methoxy-4-nitro-phenyl)-acetic acid

C9H9NO5 (211.04807040000003)


   

(4-METHOXY-2-NITRO-PHENYL)-ACETIC ACID

(4-METHOXY-2-NITRO-PHENYL)-ACETIC ACID

C9H9NO5 (211.04807040000003)


   

3-Methoxy-4-methyl-2-nitrobenzoic acid

3-Methoxy-4-methyl-2-nitrobenzoic acid

C9H9NO5 (211.04807040000003)


   
   

ETHYL 3-METHOXY-5-NITROBENZOATE

ETHYL 3-METHOXY-5-NITROBENZOATE

C9H9NO5 (211.04807040000003)


   

Methyl 2-methoxy-6-nitrobenzoate

Methyl 2-methoxy-6-nitrobenzoate

C9H9NO5 (211.04807040000003)


   

Methyl 2-(4-hydroxy-3-nitrophenyl)acetate

Methyl 2-(4-hydroxy-3-nitrophenyl)acetate

C9H9NO5 (211.04807040000003)


   

(rs)-3-carboxy-4-hydroxyphenylglycine

(rs)-3-carboxy-4-hydroxyphenylglycine

C9H9NO5 (211.04807040000003)


   

Methyl 4-Hydroxy-2-Methyl-5-Nitrobenzoate

Methyl 4-Hydroxy-2-Methyl-5-Nitrobenzoate

C9H9NO5 (211.04807040000003)


   

3-(2-nitrophenoxy)propanoic acid

3-(2-nitrophenoxy)propanoic acid

C9H9NO5 (211.04807040000003)


   

(4-METHOXY-3-NITROPHENYL)ACETIC ACID

(4-METHOXY-3-NITROPHENYL)ACETIC ACID

C9H9NO5 (211.04807040000003)


   

3-(4-Hydroxy-3-nitrophenyl)propanoic acid

3-(4-Hydroxy-3-nitrophenyl)propanoic acid

C9H9NO5 (211.04807040000003)


   

Methyl (4-nitrophenoxy)acetate

methyl 2-(4-nitrophenoxy)acetate

C9H9NO5 (211.04807040000003)


   

Benzaldehyde, 3-ethoxy-2-hydroxy-5-nitro- (9CI)

Benzaldehyde, 3-ethoxy-2-hydroxy-5-nitro- (9CI)

C9H9NO5 (211.04807040000003)


   

Methyl 2-methoxy-5-nitrobenzoate

Methyl 2-methoxy-5-nitrobenzoate

C9H9NO5 (211.04807040000003)


   

(3-METHYL-4-NITROPHENOXY)ACETIC ACID

(3-METHYL-4-NITROPHENOXY)ACETIC ACID

C9H9NO5 (211.04807040000003)


   

(S)-4-BENZYL-1,3-THIAZOLIDINE-2-ONE

(S)-4-BENZYL-1,3-THIAZOLIDINE-2-ONE

C9H9NO5 (211.04807040000003)


   

(RS)-4-CARBOXY-3-HYDROXYPHENYLGLYCINE

(RS)-4-CARBOXY-3-HYDROXYPHENYLGLYCINE

C9H9NO5 (211.04807040000003)


D002491 - Central Nervous System Agents > D018696 - Neuroprotective Agents D020011 - Protective Agents

   

methyl 3-(hydroxymethyl)-5-nitrobenzoate

methyl 3-(hydroxymethyl)-5-nitrobenzoate

C9H9NO5 (211.04807040000003)


   
   

5-Methoxy-2-nitrobenzeneacetic acid

5-Methoxy-2-nitrobenzeneacetic acid

C9H9NO5 (211.04807040000003)


   

2-METHOXY-6-NITROPHENYLACETIC ACID

2-METHOXY-6-NITROPHENYLACETIC ACID

C9H9NO5 (211.04807040000003)


   

3-(3-NITROPHENOXY)PROPIONIC ACID

3-(3-NITROPHENOXY)PROPIONIC ACID

C9H9NO5 (211.04807040000003)


   

(R)-3-Carboxy-4-hydroxyphenylglycine

(R)-3-Carboxy-4-hydroxyphenylglycine

C9H9NO5 (211.04807040000003)


   

2-(2-methoxy-5-nitrophenyl)acetic acid

2-(2-methoxy-5-nitrophenyl)acetic acid

C9H9NO5 (211.04807040000003)


   

2,4-Dihydroxy-7-(methyloxy)-2H-1,4-benzoxazin-3(4H)-one

2,4-Dihydroxy-7-(methyloxy)-2H-1,4-benzoxazin-3(4H)-one

C9H9NO5 (211.04807040000003)


   

4-formyl-2,3-dihydro-1H-azepine-2,7-dicarboxylic acid

4-formyl-2,3-dihydro-1H-azepine-2,7-dicarboxylic acid

C9H9NO5 (211.04807040000003)


   

(Z)-2-amino-3-(3,4-dihydroxyphenyl)-3-hydroxyprop-2-enoic acid

(Z)-2-amino-3-(3,4-dihydroxyphenyl)-3-hydroxyprop-2-enoic acid

C9H9NO5 (211.04807040000003)


   

4-[(Z)-3-carboxy-3-oxoprop-1-enyl]-2,3-dihydro-1H-pyrrole-2-carboxylic acid

4-[(Z)-3-carboxy-3-oxoprop-1-enyl]-2,3-dihydro-1H-pyrrole-2-carboxylic acid

C9H9NO5 (211.04807040000003)


   

2-Amino-3-(2,4,5-trihydroxyphenyl)prop-2-enoic acid

2-Amino-3-(2,4,5-trihydroxyphenyl)prop-2-enoic acid

C9H9NO5 (211.04807040000003)


   

2-Amino-3-(4-hydroxy-3,6-dioxocyclohexa-1,4-dien-1-yl)propanoic acid

2-Amino-3-(4-hydroxy-3,6-dioxocyclohexa-1,4-dien-1-yl)propanoic acid

C9H9NO5 (211.04807040000003)


   

p-Nitrobenzyl methyl carbonate

p-Nitrobenzyl methyl carbonate

C9H9NO5 (211.04807040000003)


   

2-Azaniumyl-3-(4-hydroxy-3,6-dioxocyclohexa-1,4-dien-1-yl)propanoate

2-Azaniumyl-3-(4-hydroxy-3,6-dioxocyclohexa-1,4-dien-1-yl)propanoate

C9H9NO5 (211.04807040000003)


   

Betalamic acid

Betalamic acid

C9H9NO5 (211.04807040000003)


D004396 - Coloring Agents > D050858 - Betalains

   

L-topaquinone

L-topaquinone

C9H9NO5 (211.04807040000003)


A topaquinone that has S configuration.

   

Gentisuric acid

2-[(2,5-dihydroxybenzoyl)amino]acetic acid

C9H9NO5 (211.04807040000003)


D000893 - Anti-Inflammatory Agents > D000894 - Anti-Inflammatory Agents, Non-Steroidal > D012459 - Salicylates

   

topaquinone zwitterion

topaquinone zwitterion

C9H9NO5 (211.04807040000003)


An amino acid zwitterion arising from transfer of a proton from the carboxy to the amino group of topaquinone; major structure at pH 7.3.

   

Dihydroxymethoxy-2Hbenzoxazinone

Dihydroxymethoxy-2Hbenzoxazinone

C9H9NO5 (211.04807040000003)