Exact Mass: 252.116

Exact Mass Matches: 252.116

Found 73 metabolites which its exact mass value is equals to given mass value 252.116, within given mass tolerance error 0.001 dalton. Try search metabolite list with more accurate mass tolerance error 0.0002 dalton.

Cimetidine

(Z)-N-cyano-N-methyl-N-(2-{[(5-methyl-1H-imidazol-4-yl)methyl]sulfanyl}ethyl)guanidine

C10H16N6S (252.1157)


A histamine congener, it competitively inhibits histamine binding to histamine H2 receptors. Cimetidine has a range of pharmacological actions. It inhibits gastric acid secretion, as well as pepsin and gastrins output. It also blocks the activity of cytochrome P-450 which might explain proposals for use in neoadjuvant therapy. [PubChem] A - Alimentary tract and metabolism > A02 - Drugs for acid related disorders > A02B - Drugs for peptic ulcer and gastro-oesophageal reflux disease (gord) > A02BA - H2-receptor antagonists C78276 - Agent Affecting Digestive System or Metabolism > C29701 - Anti-ulcer Agent > C29702 - Histamine-2 Receptor Antagonist D004791 - Enzyme Inhibitors > D065607 - Cytochrome P-450 Enzyme Inhibitors > D065609 - Cytochrome P-450 CYP1A2 Inhibitors D018377 - Neurotransmitter Agents > D018494 - Histamine Agents > D006633 - Histamine Antagonists D005765 - Gastrointestinal Agents > D000897 - Anti-Ulcer Agents CONFIDENCE standard compound; EAWAG_UCHEM_ID 3722 KEIO_ID C208; [MS2] KO008913 KEIO_ID C208 Cimetidine (SKF-92334) is an orally active and inverse histamine H2 receptor antagonist with a Ki of 0.6 μM. Cimetidine is a gastric acid reducer, and can be used for duodenal and gastric ulcers research. Cimetidine has anti-cancer and anti-inflammatory activity[1][2][5].

   

cis-Hinokiresinol

4-[(1Z,3S)-3-(4-hydroxyphenyl)penta-1,4-dienyl]phenol

C17H16O2 (252.115)


cis-Hinokiresinol, a type of lignan, is a natural compound found in various plants, particularly conifers like cypress. Lignans, including cis-Hinokiresinol, have garnered significant interest in the field of pharmacology and nutrition due to their diverse biological functions: 1. **Antioxidant Activity**: cis-Hinokiresinol exhibits antioxidant properties, which means it can help neutralize harmful free radicals in the body. This activity is important for protecting cells from oxidative stress, which is associated with aging and various diseases. 2. **Anti-Inflammatory Effects**: The compound has been found to possess anti-inflammatory properties. Chronic inflammation is linked to numerous diseases, including heart disease, cancer, and autoimmune disorders. By reducing inflammation, cis-Hinokiresinol may contribute to the prevention or treatment of these conditions. 3. **Anticancer Potential**: Some studies suggest that lignans, including cis-Hinokiresinol, may have anti-cancer properties. They may influence cancer cell growth, apoptosis (cell death), and angiogenesis (formation of new blood vessels in tumors). However, more research is needed to fully understand these effects. 4. **Estrogenic and Anti-Estrogenic Activities**: cis-Hinokiresinol and other lignans can bind to estrogen receptors in the body, exhibiting both estrogenic and anti-estrogenic effects. This dual activity might be beneficial in conditions where estrogen balance is crucial, such as in hormone-related cancers. 5. **Prebiotic Effects**: In the gut, lignans can be metabolized by gut bacteria into compounds with estrogenic or anti-estrogenic properties. This transformation contributes to the overall hormonal balance in the body and may have implications for health.

   

p-(3,4-Dihydro-6-methoxy-2-naphthyl)phenol

p-(3,4-Dihydro-6-methoxy-2-naphthyl)phenol

C17H16O2 (252.115)


   

2-Phenylethyl 3-phenyl-2-propenoate

2-Propenoic acid, 3-phenyl-, 2-phenylethyl ester

C17H16O2 (252.115)


2-Phenylethyl 3-phenyl-2-propenoate is a food flavour. It is isolated from the buds of Populus balsamifera (balsam poplar Food flavour. Isolated from the buds of Populus balsamifera (balsam poplar)

   

(1Z,4Z)-1,5-bis(4-hydroxyphenyl)-1,4-pentadiene

4-[(1Z,4Z)-5-(3-hydroxyphenyl)penta-1,4-dien-1-yl]phenol

C17H16O2 (252.115)


(1Z,4Z)-1,5-bis(4-hydroxyphenyl)-1,4-pentadiene is found in herbs and spices. (1Z,4Z)-1,5-bis(4-hydroxyphenyl)-1,4-pentadiene is a constituent of Alpinia galanga (greater galangal) rhizomes. Constituent of Alpinia galanga (greater galangal) rhizomes. (1Z,4Z)-1,5-bis(4-hydroxyphenyl)-1,4-pentadiene is found in herbs and spices.

   

Cinnamyl phenylacetate

(2Z)-3-Phenylprop-2-en-1-yl 2-phenylacetic acid

C17H16O2 (252.115)


Cinnamyl phenylacetate is a flavouring ingredient. Flavouring ingredient

   

Micrandrol E

6-Hydroxy-7-methoxy-1,2-dimethylphenanthrene

C17H16O2 (252.115)


   

Effusol

2,7-DIHYDROXY-1-METHYL-5-VINYL-9,10-DIHYDROPHENANTHRENE

C17H16O2 (252.115)


Effusol is a natural product found in Juncus setchuensis, Juncus effusus, and Juncus acutus with data available. Effusol, a phenolic constituent from Juncus effuses, exhibits potent scavenging activity for DPPH and ABTS radicals, with IC50 values of 79 μM and 2.73 μM, respectively. Effusol rescues CA1 LTP attenuated by corticosterone, defending the hippocampal function against stress-induced cognitive decline[1]. Effusol, a phenolic constituent from Juncus effuses, exhibits potent scavenging activity for DPPH and ABTS radicals, with IC50 values of 79 μM and 2.73 μM, respectively. Effusol rescues CA1 LTP attenuated by corticosterone, defending the hippocampal function against stress-induced cognitive decline[1].

   

Sequirin D

Sequirin D

C17H16O2 (252.115)


   

Canocarpan

Canocarpan

C17H16O2 (252.115)


   

(Z,Z)-4,4-(1,4-Pentadien-1,5-diyl)-diphenol|GA-1

(Z,Z)-4,4-(1,4-Pentadien-1,5-diyl)-diphenol|GA-1

C17H16O2 (252.115)


   

1-(4-hydroxyphenyl)-5-phenyl-2-penten-1-one

1-(4-hydroxyphenyl)-5-phenyl-2-penten-1-one

C17H16O2 (252.115)


   

1-phenylethanol cinnamate

1-phenylethanol cinnamate

C17H16O2 (252.115)


   

5,7-Dimethylflavanone

5,7-Dimethylflavanone

C17H16O2 (252.115)


   

Incargutine A

Incargutine A

C17H16O2 (252.115)


   

Thannilignan

Thannilignan

C17H16O2 (252.115)


   

(Z)-hinokiresinol

(Z)-hinokiresinol

C17H16O2 (252.115)


   

SCHEMBL1891422

SCHEMBL1891422

C17H16O2 (252.115)


   

Cimetidine

Cimetidine

C10H16N6S (252.1157)


A - Alimentary tract and metabolism > A02 - Drugs for acid related disorders > A02B - Drugs for peptic ulcer and gastro-oesophageal reflux disease (gord) > A02BA - H2-receptor antagonists C78276 - Agent Affecting Digestive System or Metabolism > C29701 - Anti-ulcer Agent > C29702 - Histamine-2 Receptor Antagonist D004791 - Enzyme Inhibitors > D065607 - Cytochrome P-450 Enzyme Inhibitors > D065609 - Cytochrome P-450 CYP1A2 Inhibitors D018377 - Neurotransmitter Agents > D018494 - Histamine Agents > D006633 - Histamine Antagonists D005765 - Gastrointestinal Agents > D000897 - Anti-Ulcer Agents Cimetidine (SKF-92334) is an orally active and inverse histamine H2 receptor antagonist with a Ki of 0.6 μM. Cimetidine is a gastric acid reducer, and can be used for duodenal and gastric ulcers research. Cimetidine has anti-cancer and anti-inflammatory activity[1][2][5].

   

(1Z,4Z)-1,5-bis(4-hydroxyphenyl)-1,4-pentadiene

4-[(1Z,4Z)-5-(3-hydroxyphenyl)penta-1,4-dien-1-yl]phenol

C17H16O2 (252.115)


   

Phenethyl cinnamate

2-Propenoic acid, 3-phenyl-, 2-phenylethyl ester

C17H16O2 (252.115)


   

FEMA 2300

Benzeneacetic acid, 3-phenyl-2-propenyl ester

C17H16O2 (252.115)


   

2-[(4-ethylamino-6-methylsulfanyl-1,3,5-triazin-2-yl)amino]-2-methyl-p ropanenitrile

2-[(4-ethylamino-6-methylsulfanyl-1,3,5-triazin-2-yl)amino]-2-methyl-p ropanenitrile

C10H16N6S (252.1157)


   

ethyl 2-(9H-fluoren-9-yl)acetate

ethyl 2-(9H-fluoren-9-yl)acetate

C17H16O2 (252.115)


   

4-(Methoxycarbonyl)furan-2-boronic acid pinacol ester

4-(Methoxycarbonyl)furan-2-boronic acid pinacol ester

C12H17BO5 (252.1169)


   

8-(BENZYLOXY)-3,4-DIHYDRONAPHTHALEN-1(2H)-ONE

8-(BENZYLOXY)-3,4-DIHYDRONAPHTHALEN-1(2H)-ONE

C17H16O2 (252.115)


   

7-(BENZYLOXY)-3,4-DIHYDRONAPHTHALEN-1(2H)-ONE

7-(BENZYLOXY)-3,4-DIHYDRONAPHTHALEN-1(2H)-ONE

C17H16O2 (252.115)


   

3,3-Diphenylpentanedial

3,3-Diphenylpentanedial

C17H16O2 (252.115)


   

6-(benzyloxy)-3,4-dihydronaphthalen-1(2H)-one

6-(benzyloxy)-3,4-dihydronaphthalen-1(2H)-one

C17H16O2 (252.115)


   

(±)-trans-1,3-Diphenylallyl acetate

(±)-trans-1,3-Diphenylallyl acetate

C17H16O2 (252.115)


   

(E)-3-[2-[(2-methylphenyl)methoxy]phenyl]prop-2-enal

(E)-3-[2-[(2-methylphenyl)methoxy]phenyl]prop-2-enal

C17H16O2 (252.115)


   

3-(4-methoxyphenyl)-3,4-dihydronaphthalen-1(2H)-one

3-(4-methoxyphenyl)-3,4-dihydronaphthalen-1(2H)-one

C17H16O2 (252.115)


   

2,2,3,3-Tetrahydro-1,1-spirobi[1H-indene]-7,7-diol

2,2,3,3-Tetrahydro-1,1-spirobi[1H-indene]-7,7-diol

C17H16O2 (252.115)


   

6-BENZYLOXY-3,4-DIHYDRO-1H-NAPHTHALEN-2-ONE

6-BENZYLOXY-3,4-DIHYDRO-1H-NAPHTHALEN-2-ONE

C17H16O2 (252.115)


   

1-[3-(Benzyloxy)phenyl]-2-methyl-2-propen-1-one

1-[3-(Benzyloxy)phenyl]-2-methyl-2-propen-1-one

C17H16O2 (252.115)


   

6-Methoxy-2-phenyltetralone

6-Methoxy-2-phenyltetralone

C17H16O2 (252.115)


   

(1S,4S)-(+)-2-(3,4-DICHLORO-BENZYL)-2,5-DIAZA-BICYCLO[2.2.1]HEPTANE

(1S,4S)-(+)-2-(3,4-DICHLORO-BENZYL)-2,5-DIAZA-BICYCLO[2.2.1]HEPTANE

C11H22Cl2N2 (252.116)


   

1,3-Dibenzoylpropane

1,3-Dibenzoylpropane

C17H16O2 (252.115)


   

(2E)-3-(2,3-DIHYDROBENZOFURAN-5-YL)PROPENOICACID

(2E)-3-(2,3-DIHYDROBENZOFURAN-5-YL)PROPENOICACID

C17H16O2 (252.115)


   

Poly(divinylbenzene-co-trimethyl(vinylbenzyl)ammonium chloride)

poly(divinyl benzene-co-trimethyl(vinyl benzyl)ammonium chloride)

C10H16N6S (252.1157)


It is used as a food additive .

   

1,1-SPIROBIINDANE-7,7-DIOL

1,1-SPIROBIINDANE-7,7-DIOL

C17H16O2 (252.115)


   

(R)-2,2,3,3-TETRAHYDRO-1,1-SPIROBI[INDENE]-7,7-DIOL, >=95

(R)-2,2,3,3-TETRAHYDRO-1,1-SPIROBI[INDENE]-7,7-DIOL, >=95

C17H16O2 (252.115)


   

1,4-diphenyl-2,3-dioxabicyclo[2.2.1]heptane

1,4-diphenyl-2,3-dioxabicyclo[2.2.1]heptane

C17H16O2 (252.115)


   

7-(benzyloxy)-3,4-dihydronaphthalen-2(1H)-one

7-(benzyloxy)-3,4-dihydronaphthalen-2(1H)-one

C17H16O2 (252.115)


   

Ethyl 4-[(E)-2-phenylvinyl]benzoate

Ethyl 4-[(E)-2-phenylvinyl]benzoate

C17H16O2 (252.115)


   

Nyasol

4-[(E,1R)-3-(4-hydroxyphenyl)-1-vinyl-prop-2-enyl]phenol

C17H16O2 (252.115)


   

(Z)-1,3-Bis(4-hydroxyphenyl)-1,4-pentadiene

(Z)-1,3-Bis(4-hydroxyphenyl)-1,4-pentadiene

C17H16O2 (252.115)


   

Cinnamyl phenylacetate

cinnamyl phenyl acetate

C17H16O2 (252.115)


   

1,3-Bis(p-hydroxyphenyl)pentane-1,4-diene

1,3-Bis(p-hydroxyphenyl)pentane-1,4-diene

C17H16O2 (252.115)


A norlignan that is pentane-1,4-diene in which a hydrogen at position 1 and a hydrogen at position 3 are replaced by p-hydroxyphenyl groups. The isomer in which the 1,2-disubstituted double bond has Z configuration is known as nyasol; the corresponding E isomer is hinokiresinol.

   

Hinokiresinol

Hinokiresinol

C17H16O2 (252.115)


A natural product found in Metasequoia glyptostroboides.

   

(-)-Hinokiresinol

4,4-(1E)-penta-1,4-diene-1,3-diyldiphenol

C17H16O2 (252.115)


A 1,3-bis(p-hydroxyphenyl)pentane-1,4-diene that has 1E,3S configuration. A natural product found in Chamaecyparis obtusa.

   

(R)-1,3-diphenyl-pentane-1,4-dione

(R)-1,3-diphenyl-pentane-1,4-dione

C17H16O2 (252.115)


   

1-cyano-2-methyl-3-[2-[(5-methyl-4H-imidazol-4-yl)methylthio]ethyl]guanidine

1-cyano-2-methyl-3-[2-[(5-methyl-4H-imidazol-4-yl)methylthio]ethyl]guanidine

C10H16N6S (252.1157)


   

5-Hydroxy-1,5-diphenyl-1-penten-3-one

5-Hydroxy-1,5-diphenyl-1-penten-3-one

C17H16O2 (252.115)


   

Ethyl 2-fluorenylmethylcarboxylate

Ethyl 2-fluorenylmethylcarboxylate

C17H16O2 (252.115)


   

4-[(1Z,3S)-3-(4-hydroxyphenyl)penta-1,4-dienyl]phenol

4-[(1Z,3S)-3-(4-hydroxyphenyl)penta-1,4-dienyl]phenol

C17H16O2 (252.115)


   

(-)-Nyasol

(-)-Nyasol

C17H16O2 (252.115)


A 1,3-bis(p-hydroxyphenyl)pentane-1,4-diene that has 1Z,3R configuration. A natural product found in Anemarrhena asphodeloides.

   

(+)-nyasol

(+)-nyasol

C17H16O2 (252.115)


A 1,3-bis(p-hydroxyphenyl)pentane-1,4-diene that has 1Z,3S configuration. A natural product found in Asparagus africanus and Asparagus cochinchinensis.

   

1-phenylethyl 3-phenylprop-2-enoate

1-phenylethyl 3-phenylprop-2-enoate

C17H16O2 (252.115)


   

4-[(1z,4z)-5-(4-hydroxyphenyl)penta-1,4-dien-1-yl]phenol

4-[(1z,4z)-5-(4-hydroxyphenyl)penta-1,4-dien-1-yl]phenol

C17H16O2 (252.115)


   

4-[(3r)-3-(4-hydroxyphenyl)penta-1,4-dien-1-yl]phenol

4-[(3r)-3-(4-hydroxyphenyl)penta-1,4-dien-1-yl]phenol

C17H16O2 (252.115)


   

benzeneacetic

NA

C17H16O2 (252.115)


{"Ingredient_id": "HBIN017754","Ingredient_name": "benzeneacetic","Alias": "NA","Ingredient_formula": "C17H16O2","Ingredient_Smile": "C1=CC=C(C=C1)CC(=O)OCC=CC2=CC=CC=C2","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "39885","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   

(2s)-5,7-dimethyl-2-phenyl-2,3-dihydro-1-benzopyran-4-one

(2s)-5,7-dimethyl-2-phenyl-2,3-dihydro-1-benzopyran-4-one

C17H16O2 (252.115)


   

(2e)-1-(4-hydroxyphenyl)-5-phenylpent-2-en-1-one

(2e)-1-(4-hydroxyphenyl)-5-phenylpent-2-en-1-one

C17H16O2 (252.115)


   

2-methoxy-7,8-dimethylphenanthren-3-ol

2-methoxy-7,8-dimethylphenanthren-3-ol

C17H16O2 (252.115)


   

4-[3-(4-hydroxyphenyl)-2-methylidenebut-3-en-1-yl]phenol

4-[3-(4-hydroxyphenyl)-2-methylidenebut-3-en-1-yl]phenol

C17H16O2 (252.115)


   

(2r)-2-(2-phenylethyl)-2,3-dihydro-1-benzopyran-4-one

(2r)-2-(2-phenylethyl)-2,3-dihydro-1-benzopyran-4-one

C17H16O2 (252.115)


   

2-(2-phenylethyl)-2,3-dihydro-1-benzopyran-4-one

2-(2-phenylethyl)-2,3-dihydro-1-benzopyran-4-one

C17H16O2 (252.115)


   

4-[5-(4-hydroxyphenyl)penta-1,4-dien-1-yl]phenol

4-[5-(4-hydroxyphenyl)penta-1,4-dien-1-yl]phenol

C17H16O2 (252.115)


   

4-[(1e,3r)-3-(4-hydroxyphenyl)penta-1,4-dien-1-yl]phenol

4-[(1e,3r)-3-(4-hydroxyphenyl)penta-1,4-dien-1-yl]phenol

C17H16O2 (252.115)


   

1-(4-hydroxyphenyl)-5-phenylpent-2-en-1-one

1-(4-hydroxyphenyl)-5-phenylpent-2-en-1-one

C17H16O2 (252.115)


   

(1s)-1-phenylethyl (2e)-3-phenylprop-2-enoate

(1s)-1-phenylethyl (2e)-3-phenylprop-2-enoate

C17H16O2 (252.115)