Exact Mass: 262.074224

Exact Mass Matches: 262.074224

Found 290 metabolites which its exact mass value is equals to given mass value 262.074224, within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error 0.001 dalton.

Carbadox

N-[(1E)-(1,4-dioxo-1λ⁵,4λ⁵-quinoxalin-2-yl)methylidene]methoxycarbohydrazide

C11H10N4O4 (262.070202)


Carbadox is found in animal foods. Animal growth promoter especially for pigs. Banned in the EU. Carbadox is a permitted in USA subject to a 45-day withdrawal period (2001) Carbadox is a drug that combats parasite infection. In early 2004 it was banned by the Canadian government as a livestock feed additive and for human consumption. The European Union also forbids the use of Carbadox at any level. It is approved in the United States for use in swine for up to 42 days before slaughter Animal growth promoter especies for pigs. Banned in the EU. Permitted in USA subject to a 45-day withdrawal period (2001) [DFC] D009676 - Noxae > D002273 - Carcinogens D009676 - Noxae > D009153 - Mutagens D000890 - Anti-Infective Agents

   

Aspartyl-Glutamate

2-[(2-Amino-3-carboxy-1-hydroxypropylidene)amino]pentanedioate

C9H14N2O7 (262.0800974)


Aspartyl-Glutamate is a dipeptide composed of aspartate and glutamate. It is an incomplete breakdown product of protein digestion or protein catabolism. Some dipeptides are known to have physiological or cell-signaling effects although most are simply short-lived intermediates on their way to specific amino acid degradation pathways following further proteolysis. This dipeptide has not yet been identified in human tissues or biofluids and so it is classified as an Expected metabolite.

   

L-beta-aspartyl-L-glutamic acid

2-[(3-Amino-3-carboxy-1-hydroxypropylidene)amino]pentanedioate

C9H14N2O7 (262.0800974)


L-beta-aspartyl-l-glutamic acid is a proteolytic breakdown product of larger proteins. It belongs to the family of N-acyl-alpha Amino Acids and Derivatives. These are compounds containing an alpha amino acid which bears an acyl group at his terminal nitrogen atom. It is found in urine (PMID: 3782411). A dipeptide found in urine (PMID: 3782411). This is a proteolytic breakdown product of larger proteins. [HMDB]

   

9-HYDROXY-8-(2-HYDROXYPROPAN-2-YL)-2H,8H,9H-FURO[2,3-H]CHROMEN-2-ONE

9-HYDROXY-8-(2-HYDROXYPROPAN-2-YL)-2H,8H,9H-FURO[2,3-H]CHROMEN-2-ONE

C14H14O5 (262.0841194)


   

6-(2-hydroxy-3-oxobutyl)-7-methoxy-2H-chromen-2-one

6-(2-hydroxy-3-oxobutyl)-7-methoxy-2H-chromen-2-one

C14H14O5 (262.0841194)


   
   

gamma-Glutamylaspartic acid

(2S)-2-{[(4S)-4-amino-4-carboxy-1-hydroxybutylidene]amino}butanedioate

C9H14N2O7 (262.0800974)


gamma-Glutamylaspartic acid is a dipeptide composed of gamma-glutamate and aspartic acid, and is a proteolytic breakdown product of larger proteins. It belongs to the family of N-acyl-alpha amino acids and derivatives. These are compounds containing an alpha amino acid which bears an acyl group at its terminal nitrogen atom. gamma-Glutamylaspartic acid is an incomplete breakdown product of protein digestion or protein catabolism. Some dipeptides are known to have physiological or cell-signaling effects although most are simply short-lived intermediates on their way to specific amino acid degradation pathways following further proteolysis. gamma-Glutamylaspartic acid is found in pulses. It is a constituent of the seeds of Vigna radiata (mung bean) and Vicia faba.

   

(S)-Rutaretin

9-hydroxy-2-(2-hydroxypropan-2-yl)-2H,3H,7H-furo[3,2-g]chromen-7-one

C14H14O5 (262.0841194)


(S)-Rutaretin is found in green vegetables. (S)-Rutaretin is isolated from seeds of Apium graveolens and Ruta graveolens (rue

   

Celereoin

4-hydroxy-2-(2-hydroxypropan-2-yl)-2H,3H,7H-furo[3,2-g]chromen-7-one

C14H14O5 (262.0841194)


Constituent of Apium graveolens. Celereoin is found in wild celery and green vegetables. Celereoin is found in green vegetables. Celereoin is a constituent of Apium graveolens.

   

Dorsteniol

2-(1,2-dihydroxypropan-2-yl)-2H,3H,7H-furo[3,2-g]chromen-7-one

C14H14O5 (262.0841194)


Dorsteniol is found in green vegetables. Dorsteniol is a constituent of Apium graveolens. Constituent of Apium graveolens. Dorsteniol is found in green vegetables.

   

3-hydroxy-2-(2-hydroxypropan-2-yl)-2H,3H,7H-furo[3,2-g]chromen-7-one

3-hydroxy-2-(2-hydroxypropan-2-yl)-2H,3H,7H-furo[3,2-g]chromen-7-one

C14H14O5 (262.0841194)


   

Glutamylaspartic acid

(2S)-2-[(2S)-2-amino-4-carboxybutanamido]butanedioic acid

C9H14N2O7 (262.0800974)


Glutamylaspartic acid is a dipeptide composed of glutamate and aspartic acid, and is a proteolytic breakdown product of larger proteins. It belongs to the family of N-acyl-alpha amino acids and derivatives. These are compounds containing an alpha amino acid which bears an acyl group at its terminal nitrogen atom. Glutamylaspartic acid is an incomplete breakdown product of protein digestion or protein catabolism. Some dipeptides are known to have physiological or cell-signaling effects although most are simply short-lived intermediates on their way to specific amino acid degradation pathways following further proteolysis. Glutamylaspartic acid is found in pulses and soybean.

   

6-(1-hydroxy-3-oxobutyl)-7-methoxy-2H-chromen-2-one

6-(1-hydroxy-3-oxobutyl)-7-methoxy-2H-chromen-2-one

C14H14O5 (262.0841194)


   

N-Acetyl-serylaspartic acid

(2S)-2-[(2S)-2-acetamido-3-hydroxypropanamido]butanedioic acid

C9H14N2O7 (262.0800974)


N-Acetyl-serylaspartic acid, also known as N-acetyl-serylaspartate, belongs to the class of organic compounds known as dipeptides. These are organic compounds containing a sequence of exactly two alpha-amino acids joined by a peptide bond. N-Acetyl-serylaspartic acid is an extremely weak basic (essentially neutral) compound (based on its pKa).

   

Indigo

2-(1,3-Dihydro-3-oxo-5-sulpho-2H-indol-2-ylidene)-3- oxoindoline-5-sulphonic acid

C16H10N2O2 (262.074224)


Indigo (indigo dye or indigotin) is an organic compound with a distinctive blue color. It is an oxindole dimer consisting of two fused oxindole rings. Indoles are compounds which consist of a pyrrole ring fused to benzene to form 2,3-benzopyrrole. Indigo is found in both plants and animals and has been detected in human urine and human tissues (PMID: 11076521; PMID: 8667928). The natural precursor to indigo is indican, a colorless, water-soluble derivative of the amino acid tryptophan. Indican readily hydrolyzes to release β-D-glucose and indoxyl. Oxidation of indoxyl by CYP450 enzymes in the liver or kidneys can convert indoxyl to indigo (PMID: 11076521). Likewise, exposure to air can convert indoxyl to indigo. In addition to the mammalian production of minute amounts of indigo, this chemical can also be recovered in far larger amounts from plants. Historically, indigo has been extracted from the leaves of certain plants of the Indigofera genus, in particular Indigofera tinctoria. Indigofera plants were commonly grown and used throughout the world for the production of indigo dyestuff. This was economically important due to the previous rarity of some blue dyestuffs historically. India was the primary supplier of indigo to Europe as early as the Greco-Roman era. The association of India with indigo is reflected in the Greek word for the dye, indikón. The Romans latinized the term to indicum, which passed into Italian dialect and eventually into English as the word indigo. Most indigo dye produced today is synthetic, constituting several thousand tons each year. It is most commonly associated with the production of denim cloth and blue jeans.

   

Indirubin

3-[(2E)-3-oxo-2,3-dihydro-1H-indol-2-ylidene]-2,3-dihydro-1H-indol-2-one

C16H10N2O2 (262.074224)


Indirubin or indigo red is an organic compound with a distinctive deep red/orange color. It is an oxindole dimer consisting of two fused oxindole rings. Indoles are compounds which consist of a pyrrole ring fused to benzene to form 2,3-benzopyrrole. Indirubin is found in both plants and animals and has been detected in human urine and human tissues (PMID: 11076521; PMID: 8667928). The precursor to indirubin is indican, a colorless, water-soluble derivative of the amino acid tryptophan which is converted to indole via microbial metabolism. Indican readily hydrolyzes to release β-D-glucose and indoxyl. Oxidation of indoxyl by CYP450 enzymes in the liver or kidneys can convert indoxyl to indirubin (PMID: 11076521). Likewise, exposure to air can convert indoxyl to indirubin. In addition to the mammalian production of minute amounts of indirubin, this chemical can also be recovered in far larger amounts from plants. Historically, indirubin has been extracted from the leaves of certain plants of the Indigofera genus, in particular Indigofera tinctoria. Indigofera plants were commonly grown and used throughout the world for the production of dyes. Indirubin is a chemical constituent of indigo naturalis (also known as qing dai), which has been used for hundreds of years in traditional Chinese medicine. It is produced by collecting the waste products from the bacterial degradation of specific forms of vegetation. Indirubin has shown anti-inflammatory and anti-angiogenesis properties in vitro (PMID: 21207415). It has also been studied for potential use in the treatment of ulcerative colitis (PMID: 23674882). D000970 - Antineoplastic Agents D004396 - Coloring Agents Indirubin (Couroupitine B) is a bis-indole alkaloid and has emarkable anticancer activity against chronic myelocytic leukemia[1][2]. Indirubin (Couroupitine B) is a bis-indole alkaloid and has emarkable anticancer activity against chronic myelocytic leukemia[1][2].

   

(+)-cis-Khellactone

9,10-dihydroxy-8,8-dimethyl-2H,8H,9H,10H-pyrano[2,3-h]chromen-2-one

C14H14O5 (262.0841194)


   

Aminonitropyrene

1-nitropyren-2-amine

C16H10N2O2 (262.074224)


   

Mecadox

2-({[(methoxycarbonyl)amino]imino}methyl)quinoxaline-1,4-diium-1,4-bis(olate)

C11H10N4O4 (262.070202)


   

Carboxymethyl cellulose, sodium salt

Sodium 2,3,4,5,6-pentahydroxyhexanal acetic acid

C8H15NaO8 (262.066459)


It is used as a food additive .

   

salicyl-6-hydroxy-2-cyclohexene-on-oyl

(2-Hydroxyphenyl)methyl 1-hydroxy-6-oxocyclohex-2-ene-1-carboxylic acid

C14H14O5 (262.0841194)


Salicyl-6-hydroxy-2-cyclohexene-on-oyl, also known as salicyl-hch or acylsaligenin, is a member of the class of compounds known as benzyloxycarbonyls. Benzyloxycarbonyls are organic compounds containing a carbonyl group substituted with a benzyloxyl group. Salicyl-6-hydroxy-2-cyclohexene-on-oyl is slightly soluble (in water) and a very weakly acidic compound (based on its pKa). Salicyl-6-hydroxy-2-cyclohexene-on-oyl can be found in a number of food items such as abiyuch, european plum, persimmon, and chinese cinnamon, which makes salicyl-6-hydroxy-2-cyclohexene-on-oyl a potential biomarker for the consumption of these food products.

   

Indirubin

(Z)-[2,3 inverted exclamation mark -Biindolinylidene]-2 inverted exclamation mark ,3-dione

C16H10N2O2 (262.074224)


A member of the class of indolones that is 1,3-dihydro-2H-indol-2-one substituted by a 3-oxo-1,3-dihydro-2H-indol-2-ylidene group at position 3. It is the active component of Dang Gui Long Hui Wan, which has been used in traditional Chinese medicine to treat inflammatory diseases and chronic myeloid leukemia. Indirubin is under investigation in clinical trial NCT01735864 (Dosage Determination Trial for Indigo Naturalis Extract in Oil Ointment). Indirubin is a natural product found in Isatis tinctoria, Couroupita guianensis, and Calanthe discolor with data available. D000970 - Antineoplastic Agents D004396 - Coloring Agents Indirubin (Couroupitine B) is a bis-indole alkaloid and has emarkable anticancer activity against chronic myelocytic leukemia[1][2]. Indirubin (Couroupitine B) is a bis-indole alkaloid and has emarkable anticancer activity against chronic myelocytic leukemia[1][2].

   

Indigo_dye

InChI=1/C16H10N2O2/c19-15-9-5-1-3-7-11(9)17-13(15)14-16(20)10-6-2-4-8-12(10)18-14/h1-8,17-18H/b14-13+

C16H10N2O2 (262.074224)


C.i. vat blue 1 is a dark blue powder with coppery luster. Occurs in isomeric forms (cis and trans). In solid state it is in the trans form. (NTP, 1992) Indigo dye is a member of hydroxyindoles. Indigo is a natural product found in Isatis tinctoria and Couroupita guianensis with data available. Indolesulfonic acid used as a dye in renal function testing for the detection of nitrates and chlorates, and in the testing of milk. D004396 - Coloring Agents

   
   

(+)-trans-Khellactone

(+)-trans-Khellactone

C14H14O5 (262.0841194)


   
   
   

3,4-Dihydro-1,2-secomicrominutinin

3,4-Dihydro-1,2-secomicrominutinin

C14H14O5 (262.0841194)


   

Nigrolineabiphenyl A

Nigrolineabiphenyl A

C14H14O5 (262.0841194)


   
   

Smyrindiol

(+)-(2S,3R)-3-Hydroxymarmesin

C14H14O5 (262.0841194)


   

Isoindigotin

Isoindigotin

C16H10N2O2 (262.074224)


Isoindigo is the acceptor of donor-acceptor (D-A) conjugated polymer, as well as an Indigo series dye. Isoindigo equips two lactam rings and strong electron-withdrawing character. Isoindigo can be used for dyeing and pigment preparation. Isoindigo shows high mobility and good ambient stability in FETs[1].

   
   

4-hydroxy-7H-pyrido[2,3,4-kl]acridine-6-carbaldehyde

4-hydroxy-7H-pyrido[2,3,4-kl]acridine-6-carbaldehyde

C16H10N2O2 (262.074224)


   

3-(1H-Indol-3-yl)-2H-benzo[b][1,4]oxazin-2-one

3-(1H-Indol-3-yl)-2H-benzo[b][1,4]oxazin-2-one

C16H10N2O2 (262.074224)


   

(+)-cis-Khellactone

(+)-cis-Khellactone

C14H14O5 (262.0841194)


   
   

3-Methoxysampangine

3-Methoxysampangine

C16H10N2O2 (262.074224)


   
   

methyl 2-(2-anilino-5-methyl-1,3-thiazol-4-yl)acetate

methyl 2-(2-anilino-5-methyl-1,3-thiazol-4-yl)acetate

C13H14N2O2S (262.0775944)


   

violaceol II

violaceol II

C14H14O5 (262.0841194)


An aromatic ether in which the ether functionality links a 2,3-dihydroxy-5-methylphenyl group with a 2,6-dihydroxy-4-methylphenyl group. Fungal metabolite isolated inter alia from Aspergillus spp.

   

4-methyl-N-(pyridin-2-ylmethyl)benzenesulfonamide

4-methyl-N-(pyridin-2-ylmethyl)benzenesulfonamide

C13H14N2O2S (262.0775944)


   
   

violaceol i

violaceol i

C14H14O5 (262.0841194)


An aromatic ether in which the ether functionality links two 2,3-dihydroxy-5-methylphenyl groups. Fungal metabolite isolated inter alia from Aspergillus spp.

   

Indigo

Indigo

C16H10N2O2 (262.074224)


D004396 - Coloring Agents

   
   

2,3-Didehydro,Me ester,Me ether-2,3-Dihydro-7-hydroxy-2-methyl-4-oxo-4H-1-benzopyran-5-acetic acid

2,3-Didehydro,Me ester,Me ether-2,3-Dihydro-7-hydroxy-2-methyl-4-oxo-4H-1-benzopyran-5-acetic acid

C14H14O5 (262.0841194)


   

4,6,8-Tri-Me ether-4,5,6,8-Tetrahydroxy-6-naphthalenecarboxaldehyde|5-Hydroxy-4,6,8-trimethoxy-2-naphthaldehyd

4,6,8-Tri-Me ether-4,5,6,8-Tetrahydroxy-6-naphthalenecarboxaldehyde|5-Hydroxy-4,6,8-trimethoxy-2-naphthaldehyd

C14H14O5 (262.0841194)


   

2-Naphthalenecarboxylic acid, 6-hydroxy-4,5-dimethoxy-, methyl ester

2-Naphthalenecarboxylic acid, 6-hydroxy-4,5-dimethoxy-, methyl ester

C14H14O5 (262.0841194)


   

2-(1H-Indol-3-yl)-4H-benzo[d][1,3]oxazin-4-one

2-(1H-Indol-3-yl)-4H-benzo[d][1,3]oxazin-4-one

C16H10N2O2 (262.074224)


   

3-(1,3-dihydroxy-5-phenoxy)-1,5-dimethoxybenzene|pisticiphloro-glucinyl ether

3-(1,3-dihydroxy-5-phenoxy)-1,5-dimethoxybenzene|pisticiphloro-glucinyl ether

C14H14O5 (262.0841194)


   
   
   

(+)-Obliquin hydrate|11-hydroxy-11,12-dihydroobliquine

(+)-Obliquin hydrate|11-hydroxy-11,12-dihydroobliquine

C14H14O5 (262.0841194)


   

(7R,8R/7S,8S)-7,8-dihydroxy-5,6-didehydrokavain

(7R,8R/7S,8S)-7,8-dihydroxy-5,6-didehydrokavain

C14H14O5 (262.0841194)


   
   
   
   
   

Peucedanone

Peucedanone

C14H14O5 (262.0841194)


A natural product found in Angelica gigas.

   
   
   

(E)-3-((3R*,4S*)-8-hydroxy-3,4-dimethyl-1-oxoisochroman-7-yl)acrylic acid|pestalotiopisorin A

(E)-3-((3R*,4S*)-8-hydroxy-3,4-dimethyl-1-oxoisochroman-7-yl)acrylic acid|pestalotiopisorin A

C14H14O5 (262.0841194)


   

(2-hydroxyphenyl)methyl 1-hydroxy-6-oxocyclohex-2-ene-1-carboxylate

(2-hydroxyphenyl)methyl 1-hydroxy-6-oxocyclohex-2-ene-1-carboxylate

C14H14O5 (262.0841194)


   
   

2-Hydroxy-2-(propyl-(2))-7-oxo-2,3-dihydro-7H-pyrano[2,3-g]-1,4-benzodioxin|2-Hydroxy-2--7-oxo-2,3-dihydro-7H-pyrano<2,3-g>-1,4-benzodioxin

2-Hydroxy-2-(propyl-(2))-7-oxo-2,3-dihydro-7H-pyrano[2,3-g]-1,4-benzodioxin|2-Hydroxy-2--7-oxo-2,3-dihydro-7H-pyrano<2,3-g>-1,4-benzodioxin

C14H14O5 (262.0841194)


   

6-Acetyl-2-isopropenyl-8-methoxy-4H-1,3-benzodioxin-4-one

6-Acetyl-2-isopropenyl-8-methoxy-4H-1,3-benzodioxin-4-one

C14H14O5 (262.0841194)


   

11-Methoxysampangine

11-Methoxysampangine

C16H10N2O2 (262.074224)


A natural product found in Ambavia gerrardii.

   

6-(2-hydroxy-3-hydroxymethyl-3-butenyl)-7-hydroxycoumarin

6-(2-hydroxy-3-hydroxymethyl-3-butenyl)-7-hydroxycoumarin

C14H14O5 (262.0841194)


   
   
   

2,3-Dimethoxy-4-hydroxy-1,2,3,4-tetrahydrodibenzofuran-1-one

2,3-Dimethoxy-4-hydroxy-1,2,3,4-tetrahydrodibenzofuran-1-one

C14H14O5 (262.0841194)


   

lawsonaphthoate B|methyl 1,4-dimethoxy-6-hydroxynaphthalene-2-carboxylate

lawsonaphthoate B|methyl 1,4-dimethoxy-6-hydroxynaphthalene-2-carboxylate

C14H14O5 (262.0841194)


   
   

5-hydroxy-2-methoxy-9-methyl-1-(2-oxopropyl)benzo[beta]oxepin-7(2H)-one

5-hydroxy-2-methoxy-9-methyl-1-(2-oxopropyl)benzo[beta]oxepin-7(2H)-one

C14H14O5 (262.0841194)


   

Polyporapyranone C

Polyporapyranone C

C14H14O5 (262.0841194)


   

1-(5-Hydroxymethyl-2-furyl)-3,4-dihydro-1H-2-benzopyran-6,7-diol

1-(5-Hydroxymethyl-2-furyl)-3,4-dihydro-1H-2-benzopyran-6,7-diol

C14H14O5 (262.0841194)


   

6-ethyl-5-hydroxy-3,7-dimethoxynaphthoquinone|ethyl-5-hydroxy-3,7-dimethoxynaphthoquinone

6-ethyl-5-hydroxy-3,7-dimethoxynaphthoquinone|ethyl-5-hydroxy-3,7-dimethoxynaphthoquinone

C14H14O5 (262.0841194)


   

9-Methoxy-7H-naphtho[1,2,3-ij][2,7]naphthyridin-7-one

9-Methoxy-7H-naphtho[1,2,3-ij][2,7]naphthyridin-7-one

C16H10N2O2 (262.074224)


   

6-Ethyl-2,7-dimethoxyjuglon

6-Ethyl-2,7-dimethoxyjuglon

C14H14O5 (262.0841194)


   

(-)-(2S)-guignardic acid ammonium salt|(-)-ammonium (2S,5Z)-2-(1-methylethyl)-4-oxo-5-(phenylmethylene)-1,3-dioxolane-2-carboxylate

(-)-(2S)-guignardic acid ammonium salt|(-)-ammonium (2S,5Z)-2-(1-methylethyl)-4-oxo-5-(phenylmethylene)-1,3-dioxolane-2-carboxylate

C14H14O5 (262.0841194)


   

Methyl 2-(6-acetyl-5-hydroxy-2,3-dihydrobenzofuran-2-yl)propenoate

Methyl 2-(6-acetyl-5-hydroxy-2,3-dihydrobenzofuran-2-yl)propenoate

C14H14O5 (262.0841194)


   

Angelidiol|hermandiol

Angelidiol|hermandiol

C14H14O5 (262.0841194)


   
   

Di-Et ester,2,5:3,4-di-O-methylene-Galactaric acid

Di-Et ester,2,5:3,4-di-O-methylene-Galactaric acid

C10H14O8 (262.0688644)


   

7-hydroxy-6-(2-hydroxy-3-methylbut-3-enyloxy)-2H-chromen-2-one|hibiscusin

7-hydroxy-6-(2-hydroxy-3-methylbut-3-enyloxy)-2H-chromen-2-one|hibiscusin

C14H14O5 (262.0841194)


   
   

2-Naphthalenecarboxylic acid, 4,5,6-trimethoxy-

2-Naphthalenecarboxylic acid, 4,5,6-trimethoxy-

C14H14O5 (262.0841194)


   

2,3-Dihydrokhellin

2,3-Dihydrokhellin

C14H14O5 (262.0841194)


   

Rutaretin

7H-Furo[3,2-g][1]benzopyran-7-one, 2,3-dihydro-9-hydroxy-2-(1-hydroxy-1-methylethyl)-, (2S)-

C14H14O5 (262.0841194)


Rutaretin is a member of psoralens. Rutaretin is a natural product found in Atalantia racemosa, Fatoua pilosa, and other organisms with data available.

   

Qianhucoumarin G

(R)-9-Hydroxy-2-(2-hydroxypropan-2-yl)-2,3-dihydro-7H-furo[3,2-g]chromen-7-one

C14H14O5 (262.0841194)


Qianhucoumarin G is a natural product found in Cyclospermum leptophyllum and Glehnia littoralis with data available.

   

Carbadox

Carbadox

C11H10N4O4 (262.070202)


CONFIDENCE standard compound; INTERNAL_ID 1175

   

9,10-dihydroxy-8,8-dimethyl-9,10-dihydropyrano[2,3-f]chromen-2-one

NCGC00384976-01!9,10-dihydroxy-8,8-dimethyl-9,10-dihydropyrano[2,3-f]chromen-2-one

C14H14O5 (262.0841194)


   

Asp-glu

Asp-glu

C9H14N2O7 (262.0800974)


A dipeptide formed from L-alpha-aspartyl and L-glutamic acid residues.

   
   
   
   

5,6-Dihydroxydihydro-deoxyuridine

5,6-Dihydroxydihydro-deoxyuridine

C9H14N2O7 (262.0800974)


   

violaceol-II_major

violaceol-II_major

C14H14O5 (262.0841194)


   

Indigo Carmine_major

Indigo Carmine_major

C16H10N2O2 (262.074224)


   
   
   

2-Thiopheneacetic acid, 5-(hydroxyphenylmethyl)-α-methyl-

2-Thiopheneacetic acid, 5-(hydroxyphenylmethyl)-α-methyl-

C14H14O3S (262.0663614)


   

b-Asp-Glu

L-beta-aspartyl-L-glutamic acid

C9H14N2O7 (262.0800974)


   

alpha-Glutamylaspartic acid

2-(2-amino-4-carboxybutanamido)butanedioic acid

C9H14N2O7 (262.0800974)


   

Glutamylaspartate

2-(4-amino-4-carboxybutanamido)butanedioic acid

C9H14N2O7 (262.0800974)


   

(S)-Rutaretin

9-hydroxy-7-(2-hydroxypropan-2-yl)-2H,6H,7H-furo[3,2-g]chromen-2-one

C14H14O5 (262.0841194)


   

Dorsteniol

7-(1,2-dihydroxypropan-2-yl)-2H,6H,7H-furo[3,2-g]chromen-2-one

C14H14O5 (262.0841194)


   

Celereoin

5-hydroxy-7-(2-hydroxypropan-2-yl)-2H,6H,7H-furo[3,2-g]chromen-2-one

C14H14O5 (262.0841194)


   

3-(4-Nitrobenzyl)-5-hydroxy-3H-imidazole-4-carboxamide

3-(4-Nitrobenzyl)-5-hydroxy-3H-imidazole-4-carboxamide

C11H10N4O4 (262.070202)


   

n-(4-aminophenyl)-4-methylbenzenesulfonamide

n-(4-aminophenyl)-4-methylbenzenesulfonamide

C13H14N2O2S (262.0775944)


   

1,1,2,2-Ethanetetracarboxylic acid, tetramethyl ester

1,1,2,2-Ethanetetracarboxylic acid, tetramethyl ester

C10H14O8 (262.0688644)


   

(5-amino-1-benzothiophen-2-yl)-morpholin-4-ylmethanone

(5-amino-1-benzothiophen-2-yl)-morpholin-4-ylmethanone

C13H14N2O2S (262.0775944)


   

Methyl 6-hydroxy-4,5-dimethoxy-2-naphthoate

Methyl 6-hydroxy-4,5-dimethoxy-2-naphthoate

C14H14O5 (262.0841194)


   

BIS(4-METHOXYPHENYL)PHOSPHINE OXIDE

BIS(4-METHOXYPHENYL)PHOSPHINE OXIDE

C14H15O3P (262.075877)


   

4,5,7-Trimethoxy-2-naphthoic acid

4,5,7-Trimethoxy-2-naphthoic acid

C14H14O5 (262.0841194)


   

Methyl 4-hydroxy-5,7-dimethoxy-2-naphthoate

Methyl 4-hydroxy-5,7-dimethoxy-2-naphthoate

C14H14O5 (262.0841194)


   

Methyl 4,5-dihydroxy-8-methoxy-6-methyl-2-naphthoate

Methyl 4,5-dihydroxy-8-methoxy-6-methyl-2-naphthoate

C14H14O5 (262.0841194)


   

4,6,7-Trimethoxy-2-naphthoic acid

4,6,7-Trimethoxy-2-naphthoic acid

C14H14O5 (262.0841194)


   

Methyl 4-hydroxy-5,8-dimethoxy-2-naphthoate

Methyl 4-hydroxy-5,8-dimethoxy-2-naphthoate

C14H14O5 (262.0841194)


   

Methyl 4-hydroxy-6,7-dimethoxy-2-naphthoate

Methyl 4-hydroxy-6,7-dimethoxy-2-naphthoate

C14H14O5 (262.0841194)


   

Ethyl 4-hydroxy-6-(methylsulfanyl)-2-naphthoate

Ethyl 4-hydroxy-6-(methylsulfanyl)-2-naphthoate

C14H14O3S (262.0663614)


   

4,5,6-Trimethoxy-2-naphthoic acid

4,5,6-Trimethoxy-2-naphthoic acid

C14H14O5 (262.0841194)


   

Methyl 4-hydroxy-7,8-dimethoxy-2-naphthoate

Methyl 4-hydroxy-7,8-dimethoxy-2-naphthoate

C14H14O5 (262.0841194)


   

Methyl 4-hydroxy-6,8-dimethoxy-2-naphthoate

Methyl 4-hydroxy-6,8-dimethoxy-2-naphthoate

C14H14O5 (262.0841194)


   

4-Hydroxy-6,7-dimethoxy-8-methyl-2-naphthoic acid

4-Hydroxy-6,7-dimethoxy-8-methyl-2-naphthoic acid

C14H14O5 (262.0841194)


   

Methyl 4-hydroxy-5,6-dimethoxy-2-naphthoate

Methyl 4-hydroxy-5,6-dimethoxy-2-naphthoate

C14H14O5 (262.0841194)


   

2-(3-TRIFLUOROMETHYL-PHENYLAMINO)-BENZONITRILE

2-(3-TRIFLUOROMETHYL-PHENYLAMINO)-BENZONITRILE

C14H9F3N2 (262.071779)


   

Bis(4-methoxyphenyl) sulfoxide

Bis(4-methoxyphenyl) sulfoxide

C14H14O3S (262.0663614)


   

Benzene, 4-(chloromethyl)-1-cyclopentyl-2-(trifluoromethyl)

Benzene, 4-(chloromethyl)-1-cyclopentyl-2-(trifluoromethyl)

C13H14ClF3 (262.073607)


   

p-Toluenesulfonamide, N-(o-aminophenyl)-

p-Toluenesulfonamide, N-(o-aminophenyl)-

C13H14N2O2S (262.0775944)


   

1-(4-TRIFLUOROMETHYLPHENYL)-1H-BENZOIMIDAZOLE

1-(4-TRIFLUOROMETHYLPHENYL)-1H-BENZOIMIDAZOLE

C14H9F3N2 (262.071779)


   

Dibenzyl phosphite

Dibenzyl phosphite

C14H15O3P (262.075877)


   

2-(4-TRIFLUOROMETHYLPHENYL)-1H-PYRROLO[2,3-C]PYRIDINE

2-(4-TRIFLUOROMETHYLPHENYL)-1H-PYRROLO[2,3-C]PYRIDINE

C14H9F3N2 (262.071779)


   

3-Cyano-2-methyl-6-phenyl-4-(trifluoromethyl)-pyridine

3-Cyano-2-methyl-6-phenyl-4-(trifluoromethyl)-pyridine

C14H9F3N2 (262.071779)


   

4-AMINO-N-O-TOLYL-BENZENESULFONAMIDE

4-AMINO-N-O-TOLYL-BENZENESULFONAMIDE

C13H14N2O2S (262.0775944)


   

5-Amino-1-(3-chloro-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-2-yl )-1H-pyrazole-4-carbonitrile

5-Amino-1-(3-chloro-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-2-yl )-1H-pyrazole-4-carbonitrile

C11H11ClN6 (262.0733676)


   

ethyl 5-(4-methoxyphenyl)thiophene-2-carboxylate

ethyl 5-(4-methoxyphenyl)thiophene-2-carboxylate

C14H14O3S (262.0663614)


   

1-(2-CHLOROETHYL)-4-(TRIFLUOROMETHYL)BENZENE

1-(2-CHLOROETHYL)-4-(TRIFLUOROMETHYL)BENZENE

C9H21Cl3N2 (262.0770236)


   

CHEMBRDG-BB 6138582

CHEMBRDG-BB 6138582

C14H14O5 (262.0841194)


   

Benzylsulfamide

4-Amino-N-(phenylmethyl)benzene sulfonamide

C13H14N2O2S (262.0775944)


C254 - Anti-Infective Agent > C28394 - Topical Anti-Infective Agent

   

4-AMINO-N-BENZYL-BENZENESULFONAMIDE

4-AMINO-N-BENZYL-BENZENESULFONAMIDE

C13H14N2O2S (262.0775944)


   

2-(hydroxymethyl)-5-[(4-methoxyphenyl)methoxy]pyran-4-one

2-(hydroxymethyl)-5-[(4-methoxyphenyl)methoxy]pyran-4-one

C14H14O5 (262.0841194)


   

5-Amino-2-methyl-N-phenylbenzenesulfonamide

5-Amino-2-methyl-N-phenylbenzenesulfonamide

C13H14N2O2S (262.0775944)


   

ethyl 2-(benzylamino)-1,3-thiazole-5-carboxylate

ethyl 2-(benzylamino)-1,3-thiazole-5-carboxylate

C13H14N2O2S (262.0775944)


   
   

2-(2-ETHYL-PYRIDIN-4-YL)-THIAZOLE-4-CARBOXYLIC ACID ETHYL ESTER

2-(2-ETHYL-PYRIDIN-4-YL)-THIAZOLE-4-CARBOXYLIC ACID ETHYL ESTER

C13H14N2O2S (262.0775944)


   

Propanedinitrile, 2-[hydroxy(4-phenoxyphenyl)Methylene]-

Propanedinitrile, 2-[hydroxy(4-phenoxyphenyl)Methylene]-

C16H10N2O2 (262.074224)


   

Boronic acid,B-benzo[b]naphtho[2,3-d]furan-3-yl-

Boronic acid,B-benzo[b]naphtho[2,3-d]furan-3-yl-

C16H11BO3 (262.0801206)


   

1-(2-chloropyrimidin-4-yl)-N-methylpiperidin-3-amine hydrochloride

1-(2-chloropyrimidin-4-yl)-N-methylpiperidin-3-amine hydrochloride

C10H16Cl2N4 (262.0751956)


   

2-Amino-N-methyl-N-phenylbenzene sulfonamide

2-Amino-N-methyl-N-phenylbenzene sulfonamide

C13H14N2O2S (262.0775944)


   

8-(cyclopropylmethoxy)-4-hydroxy-7-methoxychromen-2-one

8-(cyclopropylmethoxy)-4-hydroxy-7-methoxychromen-2-one

C14H14O5 (262.0841194)


   

N-Benzyl 3-aminobenzenesulfonamide

N-Benzyl 3-aminobenzenesulfonamide

C13H14N2O2S (262.0775944)


   

Benzenesulfonamide,4-amino-N-methyl-N-phenyl-

Benzenesulfonamide,4-amino-N-methyl-N-phenyl-

C13H14N2O2S (262.0775944)


   

(S)-METHYL 4-(4,4,4-TRIFLUORO-1-HYDROXYBUTYL)BENZOATE

(S)-METHYL 4-(4,4,4-TRIFLUORO-1-HYDROXYBUTYL)BENZOATE

C12H13F3O3 (262.0816744)


   

ETHYL2-(2-OXO-2H-CHROMEN-7-YLOXY)PROPANOATE

ETHYL2-(2-OXO-2H-CHROMEN-7-YLOXY)PROPANOATE

C14H14O5 (262.0841194)


   
   

3-(naphthalen-2-yl)-5-(trifluoromethyl)-1H-pyrazole

3-(naphthalen-2-yl)-5-(trifluoromethyl)-1H-pyrazole

C14H9F3N2 (262.071779)


   

Khellactone, cis-(-)-

Khellactone, cis-(-)-

C14H14O5 (262.0841194)


   

2-[(4-methoxyphenyl)methylthio]-6-methyl-1H-pyrimidin-4-one

2-[(4-methoxyphenyl)methylthio]-6-methyl-1H-pyrimidin-4-one

C13H14N2O2S (262.0775944)


   

3-{[(2-Furylmethyl)thio]methyl}-4-methoxybenzaldehyde

3-{[(2-Furylmethyl)thio]methyl}-4-methoxybenzaldehyde

C14H14O3S (262.0663614)


   

7H-Furo(3,2-g)(1)benzopyran-7-one, 2,3-dihydro-3-hydroxy-2-(1-hydroxy-1-methylethyl)-

7H-Furo(3,2-g)(1)benzopyran-7-one, 2,3-dihydro-3-hydroxy-2-(1-hydroxy-1-methylethyl)-

C14H14O5 (262.0841194)


   

2H-Furo(2,3-h)-1-benzopyran-2-one, 8,9-dihydro-9-hydroxy-8-(1-hydroxy-1-methylethyl)-

2H-Furo(2,3-h)-1-benzopyran-2-one, 8,9-dihydro-9-hydroxy-8-(1-hydroxy-1-methylethyl)-

C14H14O5 (262.0841194)


   

4-(4-Methyl-1,3-Dioxo-1,3-Dihydro-2h-Isoindol-2-Yl)benzonitrile

4-(4-Methyl-1,3-Dioxo-1,3-Dihydro-2h-Isoindol-2-Yl)benzonitrile

C16H10N2O2 (262.074224)


   

8,9,10-Trihydroxy-7-hydroxymethyl-3-methyl-6-oxa-1,3-diaza-spiro[4.5]decane-2,4-dione

8,9,10-Trihydroxy-7-hydroxymethyl-3-methyl-6-oxa-1,3-diaza-spiro[4.5]decane-2,4-dione

C9H14N2O7 (262.0800974)


   

Carboxymethyl cellulose

Sodium carboxymethyl cellulose

C8H15NaO8 (262.066459)


   

(S)-Rutaretin

9-hydroxy-2-(2-hydroxypropan-2-yl)-2H,3H,7H-furo[3,2-g]chromen-7-one

C14H14O5 (262.0841194)


(s)-rutaretin is a member of the class of compounds known as psoralens. Psoralens are organic compounds containing a psoralen moiety, which consists of a furan fused to a chromenone to for 7H-furo[3,2-g]chromen-7-one (s)-rutaretin is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). (s)-rutaretin can be found in green vegetables, which makes (s)-rutaretin a potential biomarker for the consumption of this food product. (S)-Rutaretin is found in green vegetables. (S)-Rutaretin is isolated from seeds of Apium graveolens and Ruta graveolens (rue

   
   

8-azido-3,8-dideoxy-D-manno-2-octulosonate

8-azido-3,8-dideoxy-D-manno-2-octulosonate

C8H12N3O7- (262.0675222)


   

4-methyl-N-(pyridin-4-ylmethyl)benzenesulfonamide

4-methyl-N-(pyridin-4-ylmethyl)benzenesulfonamide

C13H14N2O2S (262.0775944)


   

Theophylline, sodium acetate

Theophylline, sodium acetate

C9H11N4NaO4 (262.0677966)


   

1-Piperidinyl-(5-thiophen-2-yl-3-isoxazolyl)methanone

1-Piperidinyl-(5-thiophen-2-yl-3-isoxazolyl)methanone

C13H14N2O2S (262.0775944)


   

N-[2-(4-fluoroanilino)-2-oxoethyl]-2-furancarboxamide

N-[2-(4-fluoroanilino)-2-oxoethyl]-2-furancarboxamide

C13H11FN2O3 (262.0753668)


   

3,5-dimethyl-N-[2-(methylthio)phenyl]-4-isoxazolecarboxamide

3,5-dimethyl-N-[2-(methylthio)phenyl]-4-isoxazolecarboxamide

C13H14N2O2S (262.0775944)


   

(2S)-2-{[(3S)-3-amino-3-carboxypropanoyl]amino}pentanedioic acid

(2S)-2-{[(3S)-3-amino-3-carboxypropanoyl]amino}pentanedioic acid

C9H14N2O7 (262.0800974)


   

1-(3-Methoxyphenyl)-2-[(1-methyl-2-imidazolyl)thio]ethanone

1-(3-Methoxyphenyl)-2-[(1-methyl-2-imidazolyl)thio]ethanone

C13H14N2O2S (262.0775944)


   

7-Pyrrol-1-ylchromeno[2,3-b]pyridin-5-one

7-Pyrrol-1-ylchromeno[2,3-b]pyridin-5-one

C16H10N2O2 (262.074224)


   

3-(3-Furylmethylidene)-1,5-dioxaspiro[5.5]undecane-2,4-dione

3-(3-Furylmethylidene)-1,5-dioxaspiro[5.5]undecane-2,4-dione

C14H14O5 (262.0841194)


   

1-(3,4,5-Trihydroxy-7-methoxynaphthalen-2-yl)propan-2-one

1-(3,4,5-Trihydroxy-7-methoxynaphthalen-2-yl)propan-2-one

C14H14O5 (262.0841194)


   

Bis(2-hydroxypropanoyl) butanedioate

Bis(2-hydroxypropanoyl) butanedioate

C10H14O8 (262.0688644)


   

2-[2-(1,3-Benzodioxol-5-yl)ethyl]-4-hydroxy-2,3-dihydropyran-6-one

2-[2-(1,3-Benzodioxol-5-yl)ethyl]-4-hydroxy-2,3-dihydropyran-6-one

C14H14O5 (262.0841194)


   

(5E)-3-Ethyl-5-[(N-methylanilino)methylidene]-2-sulfanylidene-1,3-oxazolidin-4-one

(5E)-3-Ethyl-5-[(N-methylanilino)methylidene]-2-sulfanylidene-1,3-oxazolidin-4-one

C13H14N2O2S (262.0775944)


   

Mecadox

Carbadox

C11H10N4O4 (262.070202)


D009676 - Noxae > D002273 - Carcinogens D009676 - Noxae > D009153 - Mutagens D000890 - Anti-Infective Agents

   

gamma-Glutamylaspartic acid

gamma-Glutamylaspartic acid

C9H14N2O7 (262.0800974)


   

N-Acetyl-serylaspartic acid

N-Acetyl-serylaspartic acid

C9H14N2O7 (262.0800974)


   
   

beta-Asp-Glu

beta-Asp-Glu

C9H14N2O7 (262.0800974)


A dipeptide consisting of an L-aspartyl residue attached to L-glutamic acid via the beta-carboxy group.

   

Ng-L-Glutamyl-L-aspartic acid

Ng-L-Glutamyl-L-aspartic acid

C9H14N2O7 (262.0800974)


   

Glu-asp

Glu-asp

C9H14N2O7 (262.0800974)


A dipeptide composed of L-glutamic acid and L-aspartic acid joined by a peptide linkage.

   
   

methyl 11-hydroxy-8-oxo-2-oxatricyclo[7.4.0.0³,⁷]trideca-1(13),9,11-triene-6-carboxylate

methyl 11-hydroxy-8-oxo-2-oxatricyclo[7.4.0.0³,⁷]trideca-1(13),9,11-triene-6-carboxylate

C14H14O5 (262.0841194)


   

(2s)-6-acetyl-8-methoxy-2-(prop-1-en-2-yl)-2h-1,3-benzodioxin-4-one

(2s)-6-acetyl-8-methoxy-2-(prop-1-en-2-yl)-2h-1,3-benzodioxin-4-one

C14H14O5 (262.0841194)


   

(2r)-9-hydroxy-2-(2-hydroxypropan-2-yl)-2h,3h-furo[3,2-g]chromen-7-one

(2r)-9-hydroxy-2-(2-hydroxypropan-2-yl)-2h,3h-furo[3,2-g]chromen-7-one

C14H14O5 (262.0841194)


   

(1s,3s,4r,6r,8s,9s,12s)-8-hydroxy-6,9-dimethyl-10-methylidene-5,13-dioxapentacyclo[7.4.0.0¹,¹².0³,⁸.0⁴,⁶]tridecane-7,11-dione

(1s,3s,4r,6r,8s,9s,12s)-8-hydroxy-6,9-dimethyl-10-methylidene-5,13-dioxapentacyclo[7.4.0.0¹,¹².0³,⁸.0⁴,⁶]tridecane-7,11-dione

C14H14O5 (262.0841194)


   

[4-methoxy-5-(methylsulfanyl)-[2,2'-bipyridin]-6-yl]methanol

[4-methoxy-5-(methylsulfanyl)-[2,2'-bipyridin]-6-yl]methanol

C13H14N2O2S (262.0775944)


   

methyl 2-[(2s)-6-acetyl-5-hydroxy-2,3-dihydro-1-benzofuran-2-yl]prop-2-enoate

methyl 2-[(2s)-6-acetyl-5-hydroxy-2,3-dihydro-1-benzofuran-2-yl]prop-2-enoate

C14H14O5 (262.0841194)


   
   

3'-hydroxy-1'h-[2,2'-biindol]-3-one

3'-hydroxy-1'h-[2,2'-biindol]-3-one

C16H10N2O2 (262.074224)


   

(2r,3r)-3-hydroxy-2-(2-hydroxypropan-2-yl)-2h,3h-furo[3,2-g]chromen-7-one

(2r,3r)-3-hydroxy-2-(2-hydroxypropan-2-yl)-2h,3h-furo[3,2-g]chromen-7-one

C14H14O5 (262.0841194)


   

(2s)-2-{[(4s)-4-amino-4-carboxy-1-hydroxybutylidene]amino}butanedioic acid

(2s)-2-{[(4s)-4-amino-4-carboxy-1-hydroxybutylidene]amino}butanedioic acid

C9H14N2O7 (262.0800974)


   

(6r,7s)-6,7-dihydroxy-8,8-dimethyl-6h,7h-pyrano[3,2-g]chromen-2-one

(6r,7s)-6,7-dihydroxy-8,8-dimethyl-6h,7h-pyrano[3,2-g]chromen-2-one

C14H14O5 (262.0841194)


   

methyl (4z,6e)-5-hydroxy-7-(4-hydroxyphenyl)-3-oxohepta-4,6-dienoate

methyl (4z,6e)-5-hydroxy-7-(4-hydroxyphenyl)-3-oxohepta-4,6-dienoate

C14H14O5 (262.0841194)


   

3-[(2s,6r)-12-hydroxy-3-methylidene-5,7-dioxatricyclo[6.4.0.0²,⁶]dodeca-1(12),8,10-trien-11-yl]propanoic acid

3-[(2s,6r)-12-hydroxy-3-methylidene-5,7-dioxatricyclo[6.4.0.0²,⁶]dodeca-1(12),8,10-trien-11-yl]propanoic acid

C14H14O5 (262.0841194)


   

(9r,10s)-9,10-dihydroxy-8,8-dimethyl-9h,10h-pyrano[2,3-h]chromen-2-one

(9r,10s)-9,10-dihydroxy-8,8-dimethyl-9h,10h-pyrano[2,3-h]chromen-2-one

C14H14O5 (262.0841194)


   

1-(3',5'-dihydroxyphenyl)-2-(4''-hydroxy-phenyl)-ethane-1,2-diol

NA

C14H14O5 (262.0841194)


{"Ingredient_id": "HBIN001053","Ingredient_name": "1-(3',5'-dihydroxyphenyl)-2-(4''-hydroxy-phenyl)-ethane-1,2-diol","Alias": "NA","Ingredient_formula": "C14H14O5","Ingredient_Smile": "C1=CC(=CC=C1C(C(C2=CC(=CC(=C2)O)O)O)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "SMIT15127","TCMID_id": "6086","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   

2,7,8-trihydroxy-6-methyl-1-naphthalenecarboxaldehyde; 2'-hydroxy,7,8-di-me ether

NA

C14H14O5 (262.0841194)


{"Ingredient_id": "HBIN004997","Ingredient_name": "2,7,8-trihydroxy-6-methyl-1-naphthalenecarboxaldehyde; 2'-hydroxy,7,8-di-me ether","Alias": "NA","Ingredient_formula": "C14H14O5","Ingredient_Smile": "NA","Ingredient_weight": "262.26","OB_score": "NA","CAS_id": "205672-80-6","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "8810","PubChem_id": "NA","DrugBank_id": "NA"}

   

3,4-dihydro-1,2-secomicrominutinin

NA

C14H14O5 (262.0841194)


{"Ingredient_id": "HBIN007345","Ingredient_name": "3,4-dihydro-1,2-secomicrominutinin","Alias": "NA","Ingredient_formula": "C14H14O5","Ingredient_Smile": "C=C1COC2C1C3=C(O2)C=CC(=C3O)CCC(=O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "5708","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   

4-hydroxybenzyl sulfoxide

NA

C14H14O3S (262.0663614)


{"Ingredient_id": "HBIN010521","Ingredient_name": "4-hydroxybenzyl sulfoxide","Alias": "NA","Ingredient_formula": "C14H14O3S","Ingredient_Smile": "NA","Ingredient_weight": "262.32","OB_score": "NA","CAS_id": "189639-17-6","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "7818","PubChem_id": "NA","DrugBank_id": "NA"}

   

angelidiol

NA

C14H14O5 (262.0841194)


{"Ingredient_id": "HBIN016095","Ingredient_name": "angelidiol","Alias": "NA","Ingredient_formula": "C14H14O5","Ingredient_Smile": "CC(CO)(C1CC2=C(O1)C=CC3=C2OC(=O)C=C3)O","Ingredient_weight": "262.26 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "SMIT14299","TCMID_id": "1194","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "134715205","DrugBank_id": "NA"}

   

8-hydroxy-6,9-dimethyl-10-methylidene-5,13-dioxapentacyclo[7.4.0.0¹,¹².0³,⁸.0⁴,⁶]tridecane-7,11-dione

8-hydroxy-6,9-dimethyl-10-methylidene-5,13-dioxapentacyclo[7.4.0.0¹,¹².0³,⁸.0⁴,⁶]tridecane-7,11-dione

C14H14O5 (262.0841194)


   

6-hydroxy-7-[(4-hydroxy-3-methylbut-2-en-1-yl)oxy]chromen-2-one

6-hydroxy-7-[(4-hydroxy-3-methylbut-2-en-1-yl)oxy]chromen-2-one

C14H14O5 (262.0841194)


   

(9r,10r)-9,10-dihydroxy-8,8-dimethyl-9h,10h-pyrano[2,3-h]chromen-2-one

(9r,10r)-9,10-dihydroxy-8,8-dimethyl-9h,10h-pyrano[2,3-h]chromen-2-one

C14H14O5 (262.0841194)


   

6-(1,2-dihydroxy-2-phenylethyl)-4-methoxypyran-2-one

6-(1,2-dihydroxy-2-phenylethyl)-4-methoxypyran-2-one

C14H14O5 (262.0841194)


   

6-hydroxy-4,5-dimethoxy-8-oxatricyclo[7.4.0.0²,⁷]trideca-1(13),2(7),9,11-tetraen-3-one

6-hydroxy-4,5-dimethoxy-8-oxatricyclo[7.4.0.0²,⁷]trideca-1(13),2(7),9,11-tetraen-3-one

C14H14O5 (262.0841194)


   

(9s,10r)-9,10-dihydroxy-8,8-dimethyl-9h,10h-pyrano[2,3-h]chromen-2-one

(9s,10r)-9,10-dihydroxy-8,8-dimethyl-9h,10h-pyrano[2,3-h]chromen-2-one

C14H14O5 (262.0841194)


   

(4s,6e)-9,11-dihydroxy-4-methyl-4,5-dihydro-1h-3-benzoxecine-2,8-dione

(4s,6e)-9,11-dihydroxy-4-methyl-4,5-dihydro-1h-3-benzoxecine-2,8-dione

C14H14O5 (262.0841194)


   

(10e)-10-(hydroxymethylidene)-8,14-diazatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(16),2(7),3,5,8,11,13(17),14-octaen-12-ol

(10e)-10-(hydroxymethylidene)-8,14-diazatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(16),2(7),3,5,8,11,13(17),14-octaen-12-ol

C16H10N2O2 (262.074224)


   

5-hydroxy-8-methoxy-2,2-dimethyl-8h-furo[3,4-g]chromen-6-one

5-hydroxy-8-methoxy-2,2-dimethyl-8h-furo[3,4-g]chromen-6-one

C14H14O5 (262.0841194)


   

2'-hydroxy-1'h-[3,3'-biindol]-2-one

2'-hydroxy-1'h-[3,3'-biindol]-2-one

C16H10N2O2 (262.074224)


   

2-isopropyl-4-oxo-5-(phenylmethylidene)-1,3-dioxolane-2-carboxylic acid

2-isopropyl-4-oxo-5-(phenylmethylidene)-1,3-dioxolane-2-carboxylic acid

C14H14O5 (262.0841194)


   

2,6,7-trimethoxy-3-methylnaphthalene-1,4-dione

2,6,7-trimethoxy-3-methylnaphthalene-1,4-dione

C14H14O5 (262.0841194)


   

3-{12-hydroxy-3-methylidene-5,7-dioxatricyclo[6.4.0.0²,⁶]dodeca-1(12),8,10-trien-11-yl}propanoic acid

3-{12-hydroxy-3-methylidene-5,7-dioxatricyclo[6.4.0.0²,⁶]dodeca-1(12),8,10-trien-11-yl}propanoic acid

C14H14O5 (262.0841194)


   

6-[(1r,2r)-1,2-dihydroxy-2-phenylethyl]-4-methoxypyran-2-one

6-[(1r,2r)-1,2-dihydroxy-2-phenylethyl]-4-methoxypyran-2-one

C14H14O5 (262.0841194)


   

5,10-dihydroxy-8,8-dimethyl-9h,10h-pyrano[2,3-h]chromen-2-one

5,10-dihydroxy-8,8-dimethyl-9h,10h-pyrano[2,3-h]chromen-2-one

C14H14O5 (262.0841194)


   

6,8-dimethoxy-9-methyl-2,3-dimethylidene-1,4-benzodioxepin-5-one

6,8-dimethoxy-9-methyl-2,3-dimethylidene-1,4-benzodioxepin-5-one

C14H14O5 (262.0841194)


   

6-[(2r)-2-hydroxy-3-oxobutyl]-7-methoxychromen-2-one

6-[(2r)-2-hydroxy-3-oxobutyl]-7-methoxychromen-2-one

C14H14O5 (262.0841194)


   

14-methoxy-10,16-diazatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(16),2,4,6,9(17),10,12,14-octaen-8-one

14-methoxy-10,16-diazatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(16),2,4,6,9(17),10,12,14-octaen-8-one

C16H10N2O2 (262.074224)


   
   

7-hydroxy-6-[(2-hydroxy-3-methylbut-3-en-1-yl)oxy]chromen-2-one

7-hydroxy-6-[(2-hydroxy-3-methylbut-3-en-1-yl)oxy]chromen-2-one

C14H14O5 (262.0841194)


   

4-[(3,4-dihydroxyphenyl)methyl]-5-(hydroxymethyl)benzene-1,2-diol

4-[(3,4-dihydroxyphenyl)methyl]-5-(hydroxymethyl)benzene-1,2-diol

C14H14O5 (262.0841194)


   

7-hydroxy-15-methyl-2,11-dioxatricyclo[8.5.0.0³,⁸]pentadeca-3,5,7-triene-9,12-dione

7-hydroxy-15-methyl-2,11-dioxatricyclo[8.5.0.0³,⁸]pentadeca-3,5,7-triene-9,12-dione

C14H14O5 (262.0841194)


   

4-[(4-hydroxyphenyl)methanesulfinylmethyl]phenol

4-[(4-hydroxyphenyl)methanesulfinylmethyl]phenol

C14H14O3S (262.0663614)


   
   

(e)-2'-hydroxy-1h-[2,3'-biindolyliden]-3-one

(e)-2'-hydroxy-1h-[2,3'-biindolyliden]-3-one

C16H10N2O2 (262.074224)


   

2'-hydroxy-1'h-[2,3'-biindol]-3-one

2'-hydroxy-1'h-[2,3'-biindol]-3-one

C16H10N2O2 (262.074224)


   

1-(4,5-dihydroxy-7-methoxynaphthalen-2-yl)-2-hydroxypropan-1-one

1-(4,5-dihydroxy-7-methoxynaphthalen-2-yl)-2-hydroxypropan-1-one

C14H14O5 (262.0841194)


   

3-methoxy-10,16-diazatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(16),2(7),3,5,9(17),10,12,14-octaen-8-one

3-methoxy-10,16-diazatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(16),2(7),3,5,9(17),10,12,14-octaen-8-one

C16H10N2O2 (262.074224)


   

2-[(4-amino-4-carboxy-1-hydroxybutylidene)amino]butanedioic acid

2-[(4-amino-4-carboxy-1-hydroxybutylidene)amino]butanedioic acid

C9H14N2O7 (262.0800974)


   

(8s,9s)-9-hydroxy-8-(2-hydroxypropan-2-yl)-8h,9h-furo[2,3-h]chromen-2-one

(8s,9s)-9-hydroxy-8-(2-hydroxypropan-2-yl)-8h,9h-furo[2,3-h]chromen-2-one

C14H14O5 (262.0841194)


   

(3-hydroxyphenyl)methyl 2-(4-oxo-5,6-dihydropyran-3-yl)acetate

(3-hydroxyphenyl)methyl 2-(4-oxo-5,6-dihydropyran-3-yl)acetate

C14H14O5 (262.0841194)


   

(6z)-9,11-dihydroxy-4-methyl-4,5-dihydro-1h-3-benzoxecine-2,8-dione

(6z)-9,11-dihydroxy-4-methyl-4,5-dihydro-1h-3-benzoxecine-2,8-dione

C14H14O5 (262.0841194)


   

ethyl 2-(7-hydroxy-2-methyl-4-oxochromen-5-yl)acetate

ethyl 2-(7-hydroxy-2-methyl-4-oxochromen-5-yl)acetate

C14H14O5 (262.0841194)


   

6,7-dihydroxy-8,8-dimethyl-6h,7h-pyrano[3,2-g]chromen-2-one

6,7-dihydroxy-8,8-dimethyl-6h,7h-pyrano[3,2-g]chromen-2-one

C14H14O5 (262.0841194)


   

6,7-dihydroxy-3-(3-methoxybut-1-en-1-yl)chromen-4-one

6,7-dihydroxy-3-(3-methoxybut-1-en-1-yl)chromen-4-one

C14H14O5 (262.0841194)


   

3-(8-hydroxy-3,4-dimethyl-1-oxo-3,4-dihydro-2-benzopyran-7-yl)prop-2-enoic acid

3-(8-hydroxy-3,4-dimethyl-1-oxo-3,4-dihydro-2-benzopyran-7-yl)prop-2-enoic acid

C14H14O5 (262.0841194)


   

6-[(1s)-1-hydroxy-3-oxobutyl]-7-methoxychromen-2-one

6-[(1s)-1-hydroxy-3-oxobutyl]-7-methoxychromen-2-one

C14H14O5 (262.0841194)


   

5-(hexa-2,4-dienoyl)-4-hydroxy-2-methoxybenzoic acid

5-(hexa-2,4-dienoyl)-4-hydroxy-2-methoxybenzoic acid

C14H14O5 (262.0841194)


   

2-hydroxy-6-(hydroxymethyl)-7,8-dimethoxynaphthalene-1-carbaldehyde

2-hydroxy-6-(hydroxymethyl)-7,8-dimethoxynaphthalene-1-carbaldehyde

C14H14O5 (262.0841194)


   

4-[(3,4-dihydroxyphenyl)methyl]-5-(hydroxymethyl)benzene-1,3-diol

4-[(3,4-dihydroxyphenyl)methyl]-5-(hydroxymethyl)benzene-1,3-diol

C14H14O5 (262.0841194)


   

3-hydroxy-2-(2-hydroxypropan-2-yl)-2h,3h-furo[3,2-h]chromen-8-one

3-hydroxy-2-(2-hydroxypropan-2-yl)-2h,3h-furo[3,2-h]chromen-8-one

C14H14O5 (262.0841194)


   

(6s,7r)-6,7-dihydroxy-8,8-dimethyl-6h,7h-pyrano[3,2-g]chromen-2-one

(6s,7r)-6,7-dihydroxy-8,8-dimethyl-6h,7h-pyrano[3,2-g]chromen-2-one

C14H14O5 (262.0841194)


   

6,8-dimethoxy-3-(2-oxopropyl)chromen-2-one

6,8-dimethoxy-3-(2-oxopropyl)chromen-2-one

C14H14O5 (262.0841194)


   

(6r,7r)-6,7-dihydroxy-8,8-dimethyl-6h,7h-pyrano[3,2-g]chromen-2-one

(6r,7r)-6,7-dihydroxy-8,8-dimethyl-6h,7h-pyrano[3,2-g]chromen-2-one

C14H14O5 (262.0841194)


   

6-[(2r)-2,4-dihydroxy-3-methylidenebutyl]-7-hydroxychromen-2-one

6-[(2r)-2,4-dihydroxy-3-methylidenebutyl]-7-hydroxychromen-2-one

C14H14O5 (262.0841194)


   

6-hydroxy-7-{[(2e)-4-hydroxy-3-methylbut-2-en-1-yl]oxy}chromen-2-one

6-hydroxy-7-{[(2e)-4-hydroxy-3-methylbut-2-en-1-yl]oxy}chromen-2-one

C14H14O5 (262.0841194)


   

6-ethyl-5-hydroxy-2,7-dimethoxynaphthalene-1,4-dione

6-ethyl-5-hydroxy-2,7-dimethoxynaphthalene-1,4-dione

C14H14O5 (262.0841194)


   
   

7-hydroxy-6-{[(2s)-2-hydroxy-3-methylbut-3-en-1-yl]oxy}chromen-2-one

7-hydroxy-6-{[(2s)-2-hydroxy-3-methylbut-3-en-1-yl]oxy}chromen-2-one

C14H14O5 (262.0841194)


   

1h,1'h-[2,2'-biindolylidene]-3,3'-dione

1h,1'h-[2,2'-biindolylidene]-3,3'-dione

C16H10N2O2 (262.074224)


   

methyl 2-(6-acetyl-5-hydroxy-2,3-dihydro-1-benzofuran-2-yl)prop-2-enoate

methyl 2-(6-acetyl-5-hydroxy-2,3-dihydro-1-benzofuran-2-yl)prop-2-enoate

C14H14O5 (262.0841194)


   

4-(6,7-dimethoxy-5-methyl-2h-1,3-benzodioxol-4-yl)but-3-yn-2-one

4-(6,7-dimethoxy-5-methyl-2h-1,3-benzodioxol-4-yl)but-3-yn-2-one

C14H14O5 (262.0841194)


   

methyl 6-hydroxy-4,5-dimethoxynaphthalene-2-carboxylate

methyl 6-hydroxy-4,5-dimethoxynaphthalene-2-carboxylate

C14H14O5 (262.0841194)


   

(7r)-1,7-dihydroxy-3-(hydroxymethyl)-5,6,7,8-tetrahydroxanthen-9-one

(7r)-1,7-dihydroxy-3-(hydroxymethyl)-5,6,7,8-tetrahydroxanthen-9-one

C14H14O5 (262.0841194)


   

(2r)-2-{[(1s)-1-carboxy-2-(c-hydroxycarbonimidoyl)ethyl]amino}pentanedioic acid

(2r)-2-{[(1s)-1-carboxy-2-(c-hydroxycarbonimidoyl)ethyl]amino}pentanedioic acid

C9H14N2O7 (262.0800974)


   

3,6-dihydroxy-8-methoxy-1-methyl-1h,2h,3h-cyclopenta[c]isochromen-5-one

3,6-dihydroxy-8-methoxy-1-methyl-1h,2h,3h-cyclopenta[c]isochromen-5-one

C14H14O5 (262.0841194)


   

(2r)-2-(2-hydroxypropan-2-yl)-2h,3h-[1,4]dioxino[2,3-g]chromen-7-one

(2r)-2-(2-hydroxypropan-2-yl)-2h,3h-[1,4]dioxino[2,3-g]chromen-7-one

C14H14O5 (262.0841194)


   

2,8-dihydroxy-4,7-dimethoxy-6-methylnaphthalene-1-carbaldehyde

2,8-dihydroxy-4,7-dimethoxy-6-methylnaphthalene-1-carbaldehyde

C14H14O5 (262.0841194)


   
   

(1s,3s)-3,6-dihydroxy-8-methoxy-1-methyl-1h,2h,3h-cyclopenta[c]isochromen-5-one

(1s,3s)-3,6-dihydroxy-8-methoxy-1-methyl-1h,2h,3h-cyclopenta[c]isochromen-5-one

C14H14O5 (262.0841194)


   

(6e)-9,11-dihydroxy-4-methyl-4,5-dihydro-1h-3-benzoxecine-2,8-dione

(6e)-9,11-dihydroxy-4-methyl-4,5-dihydro-1h-3-benzoxecine-2,8-dione

C14H14O5 (262.0841194)


   

(10r)-5,10-dihydroxy-8,8-dimethyl-9h,10h-pyrano[2,3-h]chromen-2-one

(10r)-5,10-dihydroxy-8,8-dimethyl-9h,10h-pyrano[2,3-h]chromen-2-one

C14H14O5 (262.0841194)


   

methyl (3r,6r,7s)-11-hydroxy-8-oxo-2-oxatricyclo[7.4.0.0³,⁷]trideca-1(13),9,11-triene-6-carboxylate

methyl (3r,6r,7s)-11-hydroxy-8-oxo-2-oxatricyclo[7.4.0.0³,⁷]trideca-1(13),9,11-triene-6-carboxylate

C14H14O5 (262.0841194)


   

2-(2-hydroxypropan-2-yl)-2h,3h-[1,4]dioxino[2,3-g]chromen-7-one

2-(2-hydroxypropan-2-yl)-2h,3h-[1,4]dioxino[2,3-g]chromen-7-one

C14H14O5 (262.0841194)


   

(9s,10s)-9,10-dihydroxy-8,8-dimethyl-9h,10h-pyrano[2,3-h]chromen-2-one

(9s,10s)-9,10-dihydroxy-8,8-dimethyl-9h,10h-pyrano[2,3-h]chromen-2-one

C14H14O5 (262.0841194)


   

(2s)-1-(4,5-dihydroxy-7-methoxynaphthalen-2-yl)-2-hydroxypropan-1-one

(2s)-1-(4,5-dihydroxy-7-methoxynaphthalen-2-yl)-2-hydroxypropan-1-one

C14H14O5 (262.0841194)


   

12-hydroxy-8,14-diazatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(17),2,4,6,9,11,13,15-octaene-10-carbaldehyde

12-hydroxy-8,14-diazatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(17),2,4,6,9,11,13,15-octaene-10-carbaldehyde

C16H10N2O2 (262.074224)


   

3',5'-dimethoxy-[1,1'-biphenyl]-3,4,4'-triol

3',5'-dimethoxy-[1,1'-biphenyl]-3,4,4'-triol

C14H14O5 (262.0841194)


   

(2s)-2-{[(2s)-2-amino-4-carboxy-1-hydroxybutylidene]amino}butanedioic acid

(2s)-2-{[(2s)-2-amino-4-carboxy-1-hydroxybutylidene]amino}butanedioic acid

C9H14N2O7 (262.0800974)


   

(1s,10s,15s)-7-hydroxy-15-methyl-2,11-dioxatricyclo[8.5.0.0³,⁸]pentadeca-3,5,7-triene-9,12-dione

(1s,10s,15s)-7-hydroxy-15-methyl-2,11-dioxatricyclo[8.5.0.0³,⁸]pentadeca-3,5,7-triene-9,12-dione

C14H14O5 (262.0841194)


   

methyl (3s,6s,7r)-11-hydroxy-8-oxo-2-oxatricyclo[7.4.0.0³,⁷]trideca-1(13),9,11-triene-6-carboxylate

methyl (3s,6s,7r)-11-hydroxy-8-oxo-2-oxatricyclo[7.4.0.0³,⁷]trideca-1(13),9,11-triene-6-carboxylate

C14H14O5 (262.0841194)


   

(e)-[3,3'-biindolylidene]-2,2'-diol

(e)-[3,3'-biindolylidene]-2,2'-diol

C16H10N2O2 (262.074224)


   

(8s)-8-(1,2-dihydroxypropan-2-yl)-8h,9h-furo[2,3-h]chromen-2-one

(8s)-8-(1,2-dihydroxypropan-2-yl)-8h,9h-furo[2,3-h]chromen-2-one

C14H14O5 (262.0841194)


   

5-[(2e,4e)-hexa-2,4-dienoyl]-4-hydroxy-2-methoxybenzoic acid

5-[(2e,4e)-hexa-2,4-dienoyl]-4-hydroxy-2-methoxybenzoic acid

C14H14O5 (262.0841194)


   

2-hydroxy-2-(2-hydroxypropan-2-yl)-3h-furo[3,2-g]chromen-7-one

2-hydroxy-2-(2-hydroxypropan-2-yl)-3h-furo[3,2-g]chromen-7-one

C14H14O5 (262.0841194)


   

(2e)-3-[(3r,4s)-8-hydroxy-3,4-dimethyl-1-oxo-3,4-dihydro-2-benzopyran-7-yl]prop-2-enoic acid

(2e)-3-[(3r,4s)-8-hydroxy-3,4-dimethyl-1-oxo-3,4-dihydro-2-benzopyran-7-yl]prop-2-enoic acid

C14H14O5 (262.0841194)


   

4,5,6-trimethoxynaphthalene-2-carboxylic acid

4,5,6-trimethoxynaphthalene-2-carboxylic acid

C14H14O5 (262.0841194)


   

5,8-dihydroxy-6-methyl-7-(2-oxopropyl)-2,3-dihydronaphthalene-1,4-dione

5,8-dihydroxy-6-methyl-7-(2-oxopropyl)-2,3-dihydronaphthalene-1,4-dione

C14H14O5 (262.0841194)


   

methyl 5-hydroxy-7-(4-hydroxyphenyl)-3-oxohepta-4,6-dienoate

methyl 5-hydroxy-7-(4-hydroxyphenyl)-3-oxohepta-4,6-dienoate

C14H14O5 (262.0841194)


   

(2s)-9-hydroxy-2-(2-hydroxypropan-2-yl)-2h,3h-furo[3,2-g]chromen-7-one

(2s)-9-hydroxy-2-(2-hydroxypropan-2-yl)-2h,3h-furo[3,2-g]chromen-7-one

C14H14O5 (262.0841194)