Exact Mass: 268.13106700000003

Exact Mass Matches: 268.13106700000003

Found 500 metabolites which its exact mass value is equals to given mass value 268.13106700000003, within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error 0.01 dalton.

   

Diethylstilbestrol

4-[4-(4-hydroxyphenyl)hex-3-en-3-yl]phenol

C18H20O2 (268.146322)


Diethylstilbestrol is a synthetic estrogen that was developed to supplement a womans natural estrogen production. In 1971, the Food and Drug Administration (FDA) issued a Drug Bulletin advising physicians to stop prescribing DES to pregnant women because it was linked to a rare vaginal cancer in female offspring. Diethylstilbesterol is found in gram bean. Diethylstilbestrol is a synthetic nonsteroidal estrogen used in the treatment of menopausal and postmenopausal disorders. It was also used formerly as a growth promoter in animals. According to the Fourth Annual Report on Carcinogens (NTP 85-002, 1985), diethylstilbestrol has been listed as a known carcinogen. (Merck, 11th ed). G - Genito urinary system and sex hormones > G03 - Sex hormones and modulators of the genital system > G03C - Estrogens > G03CC - Estrogens, combinations with other drugs G - Genito urinary system and sex hormones > G03 - Sex hormones and modulators of the genital system > G03C - Estrogens > G03CB - Synthetic estrogens, plain L - Antineoplastic and immunomodulating agents > L02 - Endocrine therapy > L02A - Hormones and related agents > L02AA - Estrogens D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones > D004967 - Estrogens C147908 - Hormone Therapy Agent > C548 - Therapeutic Hormone > C483 - Therapeutic Estrogen D009676 - Noxae > D002273 - Carcinogens

   

Equilin

Estra-1,3,5(10),7-tetraen-17-one, 3-hydroxy-

C18H20O2 (268.146322)


D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones Same as: D04041

   

Pentostatin

(8R)-3-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-3H,6H,7H,8H-imidazo[4,5-d][1,3]diazepin-8-ol

C11H16N4O4 (268.1171496)


Pentostatin is only found in individuals that have used or taken this drug. It is a potent inhibitor of adenosine deaminase. The drug is effective in the treatment of many lymphoproliferative malignancies, particularly hairy-cell leukemia. It is also synergistic with some other antineoplastic agents and has immunosuppressive activity. [PubChem]Pentostatin is a potent transition state inhibitor of adenosine deaminase (ADA), the greatest activity of which is found in cells of the lymphoid system. T-cells have higher ADA activity than B-cells, and T-cell malignancies have higher activity than B-cell malignancies. The cytotoxicity that results from prevention of catabolism of adenosine or deoxyadenosine is thought to be due to elevated intracellular levels of dATP, which can block DNA synthesis through inhibition of ribonucleotide reductase. Intracellular activation results in incorporation into DNA as a false purine base. An additional cytotoxic effect is related to its incorporation into RNA. Cytotoxicity is cell cycle phase-specific (S-phase). D000970 - Antineoplastic Agents > D000903 - Antibiotics, Antineoplastic > D005573 - Formycins L - Antineoplastic and immunomodulating agents > L01 - Antineoplastic agents D004791 - Enzyme Inhibitors > D058892 - Adenosine Deaminase Inhibitors C471 - Enzyme Inhibitor > C2157 - Adenosine Deaminase Inhibitor

   

Lysergic acid

6-Methyl-9,10-didehydroergoline-8-carboxylic acid

C16H16N2O2 (268.12117159999997)


An ergoline alkaloid comprising 6-methylergoline having additional unsaturation at the 9,10-position and a carboxy group at the 8-position.

   

4-METHYL-2,4-BIS(4-HYDROXYPHENYL)PENT-1-ENE

Phenol, 4,4-(1,1-dimethyl-3-methylene-1,3-propanediyl)bis-

C18H20O2 (268.146322)


   

Nbbcc

butyl 9H-pyrido[3,4-b]indole-3-carboxylate

C16H16N2O2 (268.1211716)


N-Butyl-beta-carboline-3-carboxylate is a member of beta-carbolines.

   

3-Methylcholanthrene

16-methylpentacyclo[11.6.1.0²,¹¹.0⁵,¹⁰.0¹⁷,²⁰]icosa-1,3,5,7,9,11,13(20),14,16-nonaene

C21H16 (268.1251936)


   

17-Dihydro Equilenin

17alpha-Dihydroequilenin

C18H20O2 (268.146322)


   

Oprea1_798169

3-Hydroxyestra-1,3,5(10),6-tetraen-17-one

C18H20O2 (268.146322)


   
   

4,4-(2-Ethyl-1-butenylidene)diphenol

1,1-Bis(4-hydroxyphenyl)-2-ethyl-1-butene

C18H20O2 (268.146322)


   
   

5,6-Cyclopenteno-1,2-benzanthracene

2,3-Dihydro-1H-benzo[a]cyclopent[h]anthracene

C21H16 (268.1251936)


   

RIPAZEPAM

1-ethyl-3-methyl-8-phenyl-4,6-dihydropyrazolo[4,3-e][1,4]diazepin-5-one

C15H16N4O (268.1324046)


C78272 - Agent Affecting Nervous System > C29756 - Sedative and Hypnotic > C1012 - Benzodiazepine C78272 - Agent Affecting Nervous System > C28197 - Antianxiety Agent

   

Razoxane

Razoxane

C11H16N4O4 (268.1171496)


D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D054659 - Diketopiperazines D000970 - Antineoplastic Agents > D050256 - Antimitotic Agents D050258 - Mitosis Modulators

   

N-acetylcarnosine

(2R)-2-({1-hydroxy-3-[(1-hydroxyethylidene)amino]propylidene}amino)-3-(1H-imidazol-5-yl)propanoate

C11H16N4O4 (268.1171496)


N-Acetylcarnosine (NAC) is a naturally-occurring compound chemically related to the dipeptide carnosine. Its molecular structure is similar to carnosine with the exception that it carries an additional acetyl group. This makes NAC a more stable molecule which is not easily destroyed by carnosinase, an enzyme that breaks down carnosine to its constituent amino acids, beta-alanine and histidine.; NAC is a free-radical scavenger and is particularly active against lipid peroxidation in the different parts of the lens in the eye. It is the active ingredient of eye drops used in order to prevent or treat cataract. [HMDB] N-Acetylcarnosine (NAC) is a naturally-occurring compound chemically related to the dipeptide carnosine. Its molecular structure is similar to carnosine with the exception that it carries an additional acetyl group. This makes NAC a more stable molecule which is not easily destroyed by carnosinase, an enzyme that breaks down carnosine to its constituent amino acids, beta-alanine and histidine. NAC is a free-radical scavenger and is particularly active against lipid peroxidation in the different parts of the lens in the eye. It is the active ingredient of eye drops used in order to prevent or treat cataract. N-Acetylcarnosine, a natural histidine-containing dipeptide, is a source of pharmacological principal L-carnosine. N-Acetylcarnosine is a potent ophthalmic agent in human cataracts[1].

   

Kamahine C

5,5-dihydroxy-4,4,8,8-tetramethyl-7-oxaspiro[bicyclo[3.2.1]octane-6,2-oxolan]-3-en-2-one

C14H20O5 (268.13106700000003)


Kamahine A is a constituent of honey from Weinmannia racemosa. Found in honey from Kamali (Weinmannia racemosa)

   

3-carboxy-4-methyl-5-pentyl-2-furanpropanoic acid

2-(2-carboxyethyl)-4-methyl-5-pentylfuran-3-carboxylic acid

C14H20O5 (268.13106700000003)


3-Carboxy-4-methyl-5-pentyl-2-furanpropanoic acid is a urofuranic acid. Urofuranic acids are usually derived from furanoic acids, and have two carboxyl groups at the 3- and 4-positions of the furan ring.

   

Dexrazoxane

4-[(2S)-2-(3,5-dioxopiperazin-1-yl)propyl]piperazine-2,6-dione

C11H16N4O4 (268.1171496)


An antimitotic agent with immunosuppressive properties. Dexrazoxane, the (+)-enantiomorph of razoxane, provides cardioprotection against anthracycline toxicity. It appears to inhibit formation of a toxic iron-anthracycline complex. [PubChem]. The Food and Drug Administration has designated dexrazoxane as an orphan drug for use in the prevention or reduction in the incidence and severity of anthracycline-induced cardiomyopathy. V - Various > V03 - All other therapeutic products > V03A - All other therapeutic products > V03AF - Detoxifying agents for antineoplastic treatment D000970 - Antineoplastic Agents > D059003 - Topoisomerase Inhibitors > D059005 - Topoisomerase II Inhibitors D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D054659 - Diketopiperazines D000970 - Antineoplastic Agents > D050256 - Antimitotic Agents D020011 - Protective Agents > D002316 - Cardiotonic Agents D002317 - Cardiovascular Agents D050258 - Mitosis Modulators D004791 - Enzyme Inhibitors

   

Hydroxyprolyl-Histidine

2-{[hydroxy(4-hydroxypyrrolidin-2-yl)methylidene]amino}-3-(1H-imidazol-5-yl)propanoate

C11H16N4O4 (268.1171496)


Hydroxyprolyl-Histidine is a dipeptide composed of hydroxyproline and histidine. 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.

   

Histidylhydroxyproline

(2S,4R)-1-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanoyl]-4-hydroxypyrrolidine-2-carboxylic acid

C11H16N4O4 (268.1171496)


Histidinylhydroxyproline is a dipeptide composed of histidine and hydroxyproline. 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.

   

Eugenyl benzoate

Phenol, 2-methoxy-4-(2-propen-1-yl)-, 1-benzoate

C17H16O3 (268.10993859999996)


Eugenyl benzoate is found in herbs and spices. Eugenyl benzoate is a constituent of Perilla frutescens and the leaves of Dalmatian sage (Salvia officinalis). Eugenyl benzoate is a flavouring agent Constituent of Perilla frutescens and the leaves of Dalmatian sage (Salvia officinalis). Flavouring agent. Eugenyl benzoate is found in herbs and spices.

   

(+)-Lysergic acid

6-methyl-6,11-diazatetracyclo[7.6.1.0²,⁷.0¹²,¹⁶]hexadeca-1(16),2,9,12,14-pentaene-4-carboxylic acid

C16H16N2O2 (268.12117159999997)


   

3-(1-Azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-7-yl)-2-cyanoprop-2-enoic acid

3-{1-azatricyclo[7.3.1.0^{5,13}]trideca-5,7,9(13)-trien-7-yl}-2-cyanoprop-2-enoic acid

C16H16N2O2 (268.12117159999997)


   

Estra-1,3,5,7,9-pentaene-3,17beta-diol

15-methyltetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadeca-1,3,5,7,9-pentaene-5,14-diol

C18H20O2 (268.146322)


   

(8R)-3-[(4S,5R)-4-Hydroxy-5-(hydroxymethyl)oxolan-2-yl]-7,8-dihydro-4H-imidazo[4,5-d][1,3]diazepin-8-ol

(8R)-3-[(4S,5R)-4-Hydroxy-5-(hydroxymethyl)oxolan-2-yl]-7,8-dihydro-4H-imidazo[4,5-d][1,3]diazepin-8-ol

C11H16N4O4 (268.1171496)


D000970 - Antineoplastic Agents > D000903 - Antibiotics, Antineoplastic > D005573 - Formycins D004791 - Enzyme Inhibitors > D058892 - Adenosine Deaminase Inhibitors

   

Razoxane, (R)-

4-[2-(3,5-dioxopiperazin-1-yl)propyl]piperazine-2,6-dione

C11H16N4O4 (268.1171496)


   

4-Bis(2-hydroxyethyl)amino-L-phenylalanine

2-amino-3-{4-[bis(2-hydroxyethyl)amino]phenyl}propanoic acid

C13H20N2O4 (268.14230000000003)


   

1,1-Bis(4-hydroxyphenyl)cyclohexane

4-[1-(4-hydroxyphenyl)cyclohexyl]phenol

C18H20O2 (268.146322)


   

Cimetidine sulfoxide

1-Cyano-2-methyl-3-(2-(((4-methyl-1H-imidazol-5-yl)methyl)sulfinyl)ethyl)guanidine

C10H16N6OS (268.1106246)


Cimetidine sulfoxide (Cimetidine sulphoxide) is a sulfoxide metabolite of Cimetidine. Cimetidine is a histamine H2-receptor antagonist. Cimetidine has the potential for peptic ulcer disease and upper gastrointestinal haemorrhage treatment[1].

   

Hydroxymethyl cimetidine

N-cyano-N-[2-({[5-(hydroxymethyl)-3H-imidazol-4-yl]methyl}sulfanyl)ethyl]-N-methylguanidine

C10H16N6OS (268.1106246)


   

N-Acetylcarnosine

2-({1-hydroxy-3-[(1-hydroxyethylidene)amino]propylidene}amino)-3-(1H-imidazol-5-yl)propanoate

C11H16N4O4 (268.1171496)


   

N'-Benzoyl-N,N'-dimethylbenzohydrazide

4-Amino-5-fluoro-3-phenylpentanoic acid

C16H16N2O2 (268.12117159999997)


   

Nafazatrom

3-methyl-1-[2-(naphthalen-2-yloxy)ethyl]-4,5-dihydro-1H-pyrazol-5-one

C16H16N2O2 (268.12117159999997)


C78275 - Agent Affecting Blood or Body Fluid > C29750 - Thrombolytic Agent D004791 - Enzyme Inhibitors > D016859 - Lipoxygenase Inhibitors D006401 - Hematologic Agents > D005343 - Fibrinolytic Agents D050299 - Fibrin Modulating Agents D000970 - Antineoplastic Agents D002317 - Cardiovascular Agents

   

1-Methyl-1,2-dihydrobenzo[j]aceanthrylene

19-methylpentacyclo[11.6.1.0^{2,11}.0^{5,10}.0^{17,20}]icosa-1(20),2(11),3,5,7,9,12,14,16-nonaene

C21H16 (268.1251936)


   

1-(2-Benzoylphenyl)-1,3-dimethylurea

N-(2-Benzoylphenyl)-N,n-dimethylcarbamimidate

C16H16N2O2 (268.12117159999997)


   

Estrogen

4-[(3E)-4-(4-hydroxyphenyl)hex-3-en-3-yl]phenol

C18H20O2 (268.146322)


A steroid hormone that stimulates or controls the development and maintenance of female sex characteristics in mammals by binding to oestrogen receptors. The oestrogens are named for their importance in the oestrous cycle. (ChEBI). Estrogen is found in date and apricot. G - Genito urinary system and sex hormones > G03 - Sex hormones and modulators of the genital system > G03C - Estrogens > G03CC - Estrogens, combinations with other drugs G - Genito urinary system and sex hormones > G03 - Sex hormones and modulators of the genital system > G03C - Estrogens > G03CB - Synthetic estrogens, plain L - Antineoplastic and immunomodulating agents > L02 - Endocrine therapy > L02A - Hormones and related agents > L02AA - Estrogens D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones > D004967 - Estrogens C147908 - Hormone Therapy Agent > C548 - Therapeutic Hormone > C483 - Therapeutic Estrogen D009676 - Noxae > D002273 - Carcinogens

   
   
   

Papyracon B

[1aR-[1aalpha,3abeta,5E(S*),7alpha,7aS*]]-Tetrahydro-3a,7-dihydroxy-5-(2-hydroxypropylidene)-2,2-dimethyl-1H,5H-cyclopropa[c]benzofuran-4(3aH)-one

C14H20O5 (268.13106700000003)


   
   
   
   
   

O-Methylthebaol

3,4,6-Trimethoxyphenanthrene

C17H16O3 (268.10993859999996)


   
   
   

Papyracon C

[1aR-[1aalpha,3abeta,5E(R*),7a,7aS*]]-Tetrahydro-3a,7-dihydroxy-5-(2-hydroxypropylidene)-2,2-dimethyl-1H,5H-cyclopropa[c]benzofuran-4(3aH)-one

C14H20O5 (268.13106700000003)


   

Stemofuran L

Stemofuran L

C17H16O3 (268.10993859999996)


A natural product found in Stemona curtisii.

   
   
   
   
   
   
   

2-Methyl-6-methoxy-4-phenyl-2,3-dihydro-3,3-dimethylbenzofuran

2-Methyl-6-methoxy-4-phenyl-2,3-dihydro-3,3-dimethylbenzofuran

C18H20O2 (268.146322)


   

8a-hydroxy-7-methoxy-3,3,6,8,8-pentamethyl-1,2-benzodioxin-5-one

8a-hydroxy-7-methoxy-3,3,6,8,8-pentamethyl-1,2-benzodioxin-5-one

C14H20O5 (268.13106700000003)


   

Salviolone

9H-Cyclohepta[a]naphthalen-9-one,1,2,3,4- tetrahydro-10-hydroxy-4,4,8-trimethyl-

C18H20O2 (268.146322)


Salviolone is a natural product found in Salvia miltiorrhiza and Salvia paramiltiorrhiza with data available.

   

butyl 5-[(1R)-1-hydroxyethyl]-gamma-oxofuran-2-butanoate

butyl 5-[(1R)-1-hydroxyethyl]-gamma-oxofuran-2-butanoate

C14H20O5 (268.13106700000003)


   
   
   
   

(+-)-(2Xi,3aXi)-2-Methoxy-(3ar,7at)-hexahydro-spiro[cyclopropan-1,2-indan]-2r,3c-dicarbonsaeure|(+-)-(2Xi,3aXi)-2-methoxy-(3ar,7at)-hexahydro-spiro[cyclopropane-1,2-indan]-2r,3c-dicarboxylic acid

(+-)-(2Xi,3aXi)-2-Methoxy-(3ar,7at)-hexahydro-spiro[cyclopropan-1,2-indan]-2r,3c-dicarbonsaeure|(+-)-(2Xi,3aXi)-2-methoxy-(3ar,7at)-hexahydro-spiro[cyclopropane-1,2-indan]-2r,3c-dicarboxylic acid

C14H20O5 (268.13106700000003)


   
   

1-Deoxy-L-erythritol 3-O-??-D-glucopyranoside

1-Deoxy-L-erythritol 3-O-??-D-glucopyranoside

C10H20O8 (268.115812)


   
   
   

SCHEMBL20825151

SCHEMBL20825151

C18H20O2 (268.146322)


   

7-isobutyryloxy-8,9-dihydroxythymol

7-isobutyryloxy-8,9-dihydroxythymol

C14H20O5 (268.13106700000003)


   
   

(1S,2Z,4S)-1-butyl-4-hydroxy-4-[(2S)-5-oxo-2,5-dihydrofuran-2-yl]but-2-en-1-yl acetate|5S-[(4S-acetyloxy)-(1S-hydroxy)-2Z-octenyl]-2(5H)-furanone|pectinolide H

(1S,2Z,4S)-1-butyl-4-hydroxy-4-[(2S)-5-oxo-2,5-dihydrofuran-2-yl]but-2-en-1-yl acetate|5S-[(4S-acetyloxy)-(1S-hydroxy)-2Z-octenyl]-2(5H)-furanone|pectinolide H

C14H20O5 (268.13106700000003)


   
   
   
   

2,2-Dimethyl-4-(hydroxymethyl)-5-(2-chloroethyl)-6-(hydroxymethyl)indan

2,2-Dimethyl-4-(hydroxymethyl)-5-(2-chloroethyl)-6-(hydroxymethyl)indan

C15H21ClO2 (268.1229996)


   

5-(prop-1-enyl)-5-propyl-2,2 -dihydroxybiphenyl

5-(prop-1-enyl)-5-propyl-2,2 -dihydroxybiphenyl

C18H20O2 (268.146322)


   

3-hydroxy-5-methoxy-2,4-dimethyl-4-(2-methylbutyryloxy)-2,5-cyclohexadien-1-one

3-hydroxy-5-methoxy-2,4-dimethyl-4-(2-methylbutyryloxy)-2,5-cyclohexadien-1-one

C14H20O5 (268.13106700000003)


   
   

2-Methoxy-6,6-dimethyl-6H-dibenzo[b,d]pyran-9-carbaldehyde

2-Methoxy-6,6-dimethyl-6H-dibenzo[b,d]pyran-9-carbaldehyde

C17H16O3 (268.10993859999996)


   

butyl 3-(2,4-dihydroxy-5-methoxyphenyl)propionate

butyl 3-(2,4-dihydroxy-5-methoxyphenyl)propionate

C14H20O5 (268.13106700000003)


   
   
   

7-hydro xy-6,8-dimethylflavanone

7-hydro xy-6,8-dimethylflavanone

C17H16O3 (268.10993859999996)


   

4-acetyl-2-[(1E)-5-hydroxyhex-1-en-1-yl]-5-methoxy-2-methylfuran-3(2H)-one|huaspenone B

4-acetyl-2-[(1E)-5-hydroxyhex-1-en-1-yl]-5-methoxy-2-methylfuran-3(2H)-one|huaspenone B

C14H20O5 (268.13106700000003)


   
   

N1C=C(C2=CC=CC=C12)C=C1C(N(C(N1C)=N/C)C)=O

N1C=C(C2=CC=CC=C12)C=C1C(N(C(N1C)=N/C)C)=O

C15H16N4O (268.1324046)


   

3-methoxy-1,5-diphenylpentan-1-one

3-methoxy-1,5-diphenylpentan-1-one

C18H20O2 (268.146322)


   
   
   
   

(E)-1,5-bis(4-hydroxyphenyl)-pent-1-en-3-one|artamenone

(E)-1,5-bis(4-hydroxyphenyl)-pent-1-en-3-one|artamenone

C17H16O3 (268.10993859999996)


   

(?)-phenylethyl-8-O-alpha-L-rhamnopyranoside

(?)-phenylethyl-8-O-alpha-L-rhamnopyranoside

C14H20O5 (268.13106700000003)


   
   

5-(5-carboxymethyl-2-oxocyclopentyl)-3-pentenyl acetate

5-(5-carboxymethyl-2-oxocyclopentyl)-3-pentenyl acetate

C14H20O5 (268.13106700000003)


   
   
   
   
   

1alpha-chloro-2beta-hydroxyeremophil-7(11),9-dien-8-one

1alpha-chloro-2beta-hydroxyeremophil-7(11),9-dien-8-one

C15H21ClO2 (268.1229996)


   
   
   

5-(1-hydroxyethyl)-1-methyl-9,10-phenanthrene-2,7-diol|dehydrojuncuenin E

5-(1-hydroxyethyl)-1-methyl-9,10-phenanthrene-2,7-diol|dehydrojuncuenin E

C17H16O3 (268.10993859999996)


   

3-(Hydroxymethyl)-2,5-bis(3-methylbut-3-en-1-ynyl)benzene-1,4-diol|3-hydroxymethyl-2,5-bis(3-methylbut-3-en-1-ynyl)benzene-1,4-diol|sterehirsutinol

3-(Hydroxymethyl)-2,5-bis(3-methylbut-3-en-1-ynyl)benzene-1,4-diol|3-hydroxymethyl-2,5-bis(3-methylbut-3-en-1-ynyl)benzene-1,4-diol|sterehirsutinol

C17H16O3 (268.10993859999996)


   
   

6-methyl-8,9-didehydro-ergoline-8-carboxylic acid|6-Methyl-Delta8,9-ergolen-8-carbonsaeure|Delta8,9-Lysergsaeure|Lysergsaeure

6-methyl-8,9-didehydro-ergoline-8-carboxylic acid|6-Methyl-Delta8,9-ergolen-8-carbonsaeure|Delta8,9-Lysergsaeure|Lysergsaeure

C16H16N2O2 (268.12117159999997)


   
   
   
   

(3Z,9Z)-7-chloro-6-hydroxy-12-oxo-pentadeca-3,9-dien-1-yne

(3Z,9Z)-7-chloro-6-hydroxy-12-oxo-pentadeca-3,9-dien-1-yne

C15H21ClO2 (268.1229996)


   
   

3-hydroxy-5-methoxy-2,6-dimethyl-6-(2-methylbutyryloxy)-2,4-cyclohexadien-1-one

3-hydroxy-5-methoxy-2,6-dimethyl-6-(2-methylbutyryloxy)-2,4-cyclohexadien-1-one

C14H20O5 (268.13106700000003)


   
   
   
   

3,4-dimethyl-5-carboxyethyl-2-furanpentanoic acid

3,4-dimethyl-5-carboxyethyl-2-furanpentanoic acid

C14H20O5 (268.13106700000003)


   

7,8-Dihydroxy-isobutyryl-thymol

7,8-Dihydroxy-isobutyryl-thymol

C14H20O5 (268.13106700000003)


   
   

2-Phenoxy-1-phenyl-pentan-1,3-dion|2-phenoxy-1-phenyl-pentane-1,3-dione

2-Phenoxy-1-phenyl-pentan-1,3-dion|2-phenoxy-1-phenyl-pentane-1,3-dione

C17H16O3 (268.10993859999996)


   

5-formyl-2,6-dihydroxy-1,7-dimethyl-9,10-dihydrophenanthrene

5-formyl-2,6-dihydroxy-1,7-dimethyl-9,10-dihydrophenanthrene

C17H16O3 (268.10993859999996)


   

1,3-bis(4-methoxyphenyl)prop-2-en-1-one

1,3-bis(4-methoxyphenyl)prop-2-en-1-one

C17H16O3 (268.10993859999996)


   

9,10-Dihydro-3,7-dihydroxy-2,8-dimethyl-4-phenanthrenecarboxaldehyde

9,10-Dihydro-3,7-dihydroxy-2,8-dimethyl-4-phenanthrenecarboxaldehyde

C17H16O3 (268.10993859999996)


   
   

[1,1-Biphenyl]-2,2-diol, 5-(2-propenyl)-5-propyl-

[1,1-Biphenyl]-2,2-diol, 5-(2-propenyl)-5-propyl-

C18H20O2 (268.146322)


   

8,9-Dihydroxy-10-isobutyryloxythymol

8,9-Dihydroxy-10-isobutyryloxythymol

C14H20O5 (268.13106700000003)


   

3-hydroxy-13-methyl-7,8,12,14,15,16-hexahydro-6H-cyclopenta[a]phenanthren-17-one

3-hydroxy-13-methyl-7,8,12,14,15,16-hexahydro-6H-cyclopenta[a]phenanthren-17-one

C18H20O2 (268.146322)


   

1-(2-Methylpropanoyl)-(E)-3-Tridecene-5,7,9,11-tetrayne-1,2-diol|1-isobutyryloxy-tridec-3E-en-5,7,9,11-tetrayn-2-ol

1-(2-Methylpropanoyl)-(E)-3-Tridecene-5,7,9,11-tetrayne-1,2-diol|1-isobutyryloxy-tridec-3E-en-5,7,9,11-tetrayn-2-ol

C17H16O3 (268.10993859999996)


   

Acetic acid 3-(3,4,5-trimethoxyphenyl)propyl ester

Acetic acid 3-(3,4,5-trimethoxyphenyl)propyl ester

C14H20O5 (268.13106700000003)


   

(E)-4,4-dihydroxy-7-en-8,8-lignan

(E)-4,4-dihydroxy-7-en-8,8-lignan

C18H20O2 (268.146322)


   

6-Methoxy-4-phenyl-3,3-dimethylbenzofuran-2(3H)-one

6-Methoxy-4-phenyl-3,3-dimethylbenzofuran-2(3H)-one

C17H16O3 (268.10993859999996)


   
   

4,4-Dimethoxychalcone

(E)-beta-(4-Methoxyphenyl)-4-methoxyacrylophenone

C17H16O3 (268.10993859999996)


See also: Angelica keiskei root (part of). 4,4'-Dimethoxychalcone acts as a natural autophagy inducer with anti-ageing properties[1]. 4,4'-Dimethoxychalcone acts as a natural autophagy inducer with anti-ageing properties[1].

   

Heudelotine

(8R)-14-hydroxy-7,7,13-trimethyltricyclo[9.4.0.03,8]pentadeca-1(11),2,4,12,14-pentaen-6-one

C18H20O2 (268.146322)


Heudelotine is a natural product found in Jatropha curcas and Ricinodendron heudelotii with data available.

   

Diethylstilbestrol

Diethylstilbestrol (Stilbestrol)

C18H20O2 (268.146322)


G - Genito urinary system and sex hormones > G03 - Sex hormones and modulators of the genital system > G03C - Estrogens > G03CC - Estrogens, combinations with other drugs G - Genito urinary system and sex hormones > G03 - Sex hormones and modulators of the genital system > G03C - Estrogens > G03CB - Synthetic estrogens, plain L - Antineoplastic and immunomodulating agents > L02 - Endocrine therapy > L02A - Hormones and related agents > L02AA - Estrogens D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones > D004967 - Estrogens C147908 - Hormone Therapy Agent > C548 - Therapeutic Hormone > C483 - Therapeutic Estrogen D009676 - Noxae > D002273 - Carcinogens CONFIDENCE standard compound; INTERNAL_ID 4237 CONFIDENCE standard compound; INTERNAL_ID 4161

   

3,6-diphenylcyclohexane-1,2-diol

NCGC00381044-02!3,6-diphenylcyclohexane-1,2-diol

C18H20O2 (268.146322)


   

3,6-diphenylcyclohexane-1,2-diol

NCGC00381044-01!3,6-diphenylcyclohexane-1,2-diol

C18H20O2 (268.146322)


   

2-Hydroxy-5-methyl-4-methoxychalcone

2-Hydroxy-5-methyl-4-methoxychalcone

C17H16O3 (268.10993859999996)


   

3,6-diphenylcyclohexane-1,2-diol

3,6-diphenylcyclohexane-1,2-diol

C18H20O2 (268.146322)


   

N-Acetylcarnosine

N-Acetylcarnosine

C11H16N4O4 (268.1171496)


A dipeptide that is the N-acetyl derivative of carnosine. MS2 deconvoluted using MS2Dec from all ion fragmentation data, MetaboLights identifier MTBLS1040; BKAYIFDRRZZKNF-VIFPVBQESA-N_STSL_0185_N-acetyl-L-carnosine_0500fmol_180425_S2_LC02_MS02_25; Spectrum acquired as described in Naz et al 2017 PMID 28641411. Preparation and submission to MassBank of North America by Chaleckis R. and Tada I. MS2 deconvoluted using CorrDec from all ion fragmentation data, MetaboLights identifier MTBLS1040; Spectrum acquired as described in Naz et al 2017 PMID 28641411. Preparation and submission to MassBank of North America by Chaleckis R. and Tada I.

   

PENTOSTATIN

PENTOSTATIN

C11H16N4O4 (268.1171496)


A member of the class of coformycins that is coformycin in which the hydroxy group at position 2 is replaced with a hydrogen. It is a drug used for the treatment of hairy cell leukaemia. D000970 - Antineoplastic Agents > D000903 - Antibiotics, Antineoplastic > D005573 - Formycins L - Antineoplastic and immunomodulating agents > L01 - Antineoplastic agents D004791 - Enzyme Inhibitors > D058892 - Adenosine Deaminase Inhibitors C471 - Enzyme Inhibitor > C2157 - Adenosine Deaminase Inhibitor

   

3,6-diphenylcyclohexane-1,2-diol [IIN-based on: CCMSLIB00000845865]

NCGC00381044-01!3,6-diphenylcyclohexane-1,2-diol [IIN-based on: CCMSLIB00000845865]

C18H20O2 (268.146322)


   

3,6-diphenylcyclohexane-1,2-diol [IIN-based: Match]

NCGC00381044-01!3,6-diphenylcyclohexane-1,2-diol [IIN-based: Match]

C18H20O2 (268.146322)


   

2-(Cyclohexylmethylsulfamoyl)aniline

2-Amino-N-cyclohexyl-N-methylbenzenesulfonamide

C13H20N2O2S (268.124542)


CONFIDENCE standard compound; INTERNAL_ID 1229; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9150; ORIGINAL_PRECURSOR_SCAN_NO 9149 CONFIDENCE standard compound; INTERNAL_ID 1229; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9156; ORIGINAL_PRECURSOR_SCAN_NO 9152 CONFIDENCE standard compound; INTERNAL_ID 1229; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9179; ORIGINAL_PRECURSOR_SCAN_NO 9178 CONFIDENCE standard compound; INTERNAL_ID 1229; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9206; ORIGINAL_PRECURSOR_SCAN_NO 9204 CONFIDENCE standard compound; INTERNAL_ID 1229; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9228; ORIGINAL_PRECURSOR_SCAN_NO 9225 CONFIDENCE standard compound; INTERNAL_ID 1229; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9193; ORIGINAL_PRECURSOR_SCAN_NO 9192

   

N-Acetyl-carnosine; LC-tDDA; CE10

N-Acetyl-carnosine; LC-tDDA; CE10

C11H16N4O4 (268.1171496)


   

N-Acetyl-carnosine; LC-tDDA; CE20

N-Acetyl-carnosine; LC-tDDA; CE20

C11H16N4O4 (268.1171496)


   

N-Acetyl-carnosine; LC-tDDA; CE30

N-Acetyl-carnosine; LC-tDDA; CE30

C11H16N4O4 (268.1171496)


   

N-Acetyl-carnosine; LC-tDDA; CE40

N-Acetyl-carnosine; LC-tDDA; CE40

C11H16N4O4 (268.1171496)


   

3,6-diphenylcyclohexane-1,2-diol_major

3,6-diphenylcyclohexane-1,2-diol_major

C18H20O2 (268.146322)


   

3,6-diphenylcyclohexane-1,2-diol_minor

3,6-diphenylcyclohexane-1,2-diol_minor

C18H20O2 (268.146322)


   
   

Dihydroxymelphalan

Dihydroxy Melphatalan-d8

C13H20N2O4 (268.14230000000003)


   

5-Hydroxymethylcimetidine

5-Hydroxymethylcimetidine

C10H16N6OS (268.1106246)


   

Eugenyl benzoate

Phenol,2-methoxy-4-(2-propen-1-yl)-, 1-benzoate

C17H16O3 (268.10993859999996)


   
   

5,8,11,14-Octadecatetraynoic acid

5,8,11,14-Octadecatetraynoic acid

C18H20O2 (268.146322)


   

Dexrazoxane

Dexrazoxane

C11H16N4O4 (268.1171496)


V - Various > V03 - All other therapeutic products > V03A - All other therapeutic products > V03AF - Detoxifying agents for antineoplastic treatment D000970 - Antineoplastic Agents > D059003 - Topoisomerase Inhibitors > D059005 - Topoisomerase II Inhibitors D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D054659 - Diketopiperazines D020011 - Protective Agents > D002316 - Cardiotonic Agents D002317 - Cardiovascular Agents D004791 - Enzyme Inhibitors

   

Hpro-his

1-[2-amino-3-(1H-imidazol-5-yl)propanoyl]-4-hydroxypyrrolidine-2-carboxylic acid

C11H16N4O4 (268.1171496)


   

His-HPro

2-[(4-hydroxypyrrolidin-2-yl)formamido]-3-(1H-imidazol-5-yl)propanoic acid

C11H16N4O4 (268.1171496)


   

Kamahine C

5,5-dihydroxy-4,4,8,8-tetramethyl-7-oxaspiro[bicyclo[3.2.1]octane-6,2-oxolan]-3-en-2-one

C14H20O5 (268.13106700000003)


   
   

FA 18:8

Octadeca-15,17-(E)-dien-9,11,13-triynoic acid

C18H20O2 (268.146322)


   

CMPentylF

2-(2-carboxyethyl)-4-methyl-5-pentylfuran-3-carboxylic acid

C14H20O5 (268.13106700000003)


   

FA 14:4;O3

1R,2R,2E)-2-(5-methoxy-5-oxo-2- penten-1-yl)-3-oxo-cyclopentaneacetic acid methyl ester

C14H20O5 (268.13106700000003)


   

Hippulin

14-isoestra-1,3,5(10),8-tetraen-3-ol-17-one

C18H20O2 (268.146322)


   
   

2-(4-propylbenzoyl)benzoic acid

2-(4-propylbenzoyl)benzoic acid

C17H16O3 (268.10993859999996)


   

4-(2,2-DIETHOXY-ETHOXY)-BENZOIC ACID METHYL ESTER

4-(2,2-DIETHOXY-ETHOXY)-BENZOIC ACID METHYL ESTER

C14H20O5 (268.13106700000003)


   

9-(2-Carboxy-2-cyanovinyl)julolidine

9-(2-Carboxy-2-cyanovinyl)julolidine

C16H16N2O2 (268.12117159999997)


   

(4-CHLORO-BENZYL)-(3-MORPHOLIN-4-YL-PROPYL)-AMINE

(4-CHLORO-BENZYL)-(3-MORPHOLIN-4-YL-PROPYL)-AMINE

C14H21ClN2O (268.1342326)


   

2-methyl-4-oxo-4-(4-phenylphenyl)butanoic acid

2-methyl-4-oxo-4-(4-phenylphenyl)butanoic acid

C17H16O3 (268.10993859999996)


   

Phosphonic acid,P-(3,3-diethoxypropyl)-, diethyl ester

Phosphonic acid,P-(3,3-diethoxypropyl)-, diethyl ester

C11H25O5P (268.143953)


   
   

(2R,3R)-2,3-DIHYDROXYBUTANEDIHYDRAZIDE

(2R,3R)-2,3-DIHYDROXYBUTANEDIHYDRAZIDE

C12H14F2N4O (268.1135618)


   

3,6-Bis(3,5-dimethyl-1H-pyrazol-1-yl)-1,2,4,5-tetrazine

3,6-Bis(3,5-dimethyl-1H-pyrazol-1-yl)-1,2,4,5-tetrazine

C14H16N6 (268.1436376)


   

3-(PIPERIDIN-4-YL)-5-(TRIFLUOROMETHYL)-1H-INDOLE

3-(PIPERIDIN-4-YL)-5-(TRIFLUOROMETHYL)-1H-INDOLE

C14H15F3N2 (268.1187266)


   

Phenol,4-(3,4-dihydro-2,2,4-trimethyl-2H-1-benzopyran-4-yl)-

Phenol,4-(3,4-dihydro-2,2,4-trimethyl-2H-1-benzopyran-4-yl)-

C18H20O2 (268.146322)


   

2-(4-propan-2-ylbenzoyl)benzoic acid

2-(4-propan-2-ylbenzoyl)benzoic acid

C17H16O3 (268.10993859999996)


   

(2-CHLORO-5-METHYL-PHENOXY)-ACETICACID

(2-CHLORO-5-METHYL-PHENOXY)-ACETICACID

C14H21ClN2O (268.1342326)


   

tert-Butyl 4-(2,2,2-trifluoroethyl)piperazine-1-carboxylate

tert-Butyl 4-(2,2,2-trifluoroethyl)piperazine-1-carboxylate

C11H19F3N2O2 (268.13985499999995)


   
   
   

N-[3-Fluoro-4-[(methylamino)carbonyl]phenyl]-2-methylalanine methyl ester

N-[3-Fluoro-4-[(methylamino)carbonyl]phenyl]-2-methylalanine methyl ester

C13H17FN2O3 (268.12231440000005)


   

4-(TERT-BUTYL)-2-METHYL-[1,1-BIPHENYL]-4-CARBOXYLIC ACID

4-(TERT-BUTYL)-2-METHYL-[1,1-BIPHENYL]-4-CARBOXYLIC ACID

C18H20O2 (268.146322)


   

tert-butyl 3-(2-methyl-1,3-thiazol-4-yl)pyrrolidine-1-carboxylate

tert-butyl 3-(2-methyl-1,3-thiazol-4-yl)pyrrolidine-1-carboxylate

C13H20N2O2S (268.124542)


   

ETHYL 4-ACETYL-[1,1-BIPHENYL]-4-CARBOXYLATE

ETHYL 4-ACETYL-[1,1-BIPHENYL]-4-CARBOXYLATE

C17H16O3 (268.10993859999996)


   

4-ACETYL-4-CYANO-5-(INDOL-3-YL)PENTAN-2-ONE

4-ACETYL-4-CYANO-5-(INDOL-3-YL)PENTAN-2-ONE

C16H16N2O2 (268.12117159999997)


   

1-Hexyl-3-Methylimidazolium Perchlorate

1-Hexyl-3-Methylimidazolium Perchlorate

C10H21ClN2O4 (268.1189776)


   

1,3-bis(3-cyanopropyl)tetramethyldisiloxane

1,3-bis(3-cyanopropyl)tetramethyldisiloxane

C12H24N2OSi2 (268.14270939999994)


   

1H-Inden-1-one,2,3-dihydro-5-methoxy-6-(phenylmethoxy)-

1H-Inden-1-one,2,3-dihydro-5-methoxy-6-(phenylmethoxy)-

C17H16O3 (268.10993859999996)


   

Deanol acetamidobenzoate

2-DIMETHYLAMINOETHANOL-p-ACETAMIDO-BENZOATE

C13H20N2O4 (268.14230000000003)


C78272 - Agent Affecting Nervous System > C47795 - CNS Stimulant

   

(1Z,3Z)-1,4-DIIODO-2,3-DIMETHYL-BUTA-1,3-DIENE

(1Z,3Z)-1,4-DIIODO-2,3-DIMETHYL-BUTA-1,3-DIENE

C11H19F3N2O2 (268.13985499999995)


   

3-Methoxy-5-[(E)-2-phenylvinyl]phenyl acetate

3-Methoxy-5-[(E)-2-phenylvinyl]phenyl acetate

C17H16O3 (268.10993859999996)


   

(1S,2S)-(-)-N-(4-TOLUENESULPHONYL)-1,2-DIAMINOCYCLOHEXANE

(1S,2S)-(-)-N-(4-TOLUENESULPHONYL)-1,2-DIAMINOCYCLOHEXANE

C13H20N2O2S (268.124542)


   

3-(Di-tert-butylphosphino)propane-1-sulfonic acid

3-(Di-tert-butylphosphino)propane-1-sulfonic acid

C11H25O3PS (268.126195)


   

Methyl 3-O-benzyl-a-L-rhamnopyranoside

Methyl 3-O-benzyl-a-L-rhamnopyranoside

C14H20O5 (268.13106700000003)


   

ETHYL 3,4,5-TRIMETHOXYPHENYL PROPIONATE

ETHYL 3,4,5-TRIMETHOXYPHENYL PROPIONATE

C14H20O5 (268.13106700000003)


   

1-[4-(1,3-dioxolan-2-yl)phenyl]-2-phenylethanone

1-[4-(1,3-dioxolan-2-yl)phenyl]-2-phenylethanone

C17H16O3 (268.10993859999996)


   

N-ETHYL-N-METHYL-3-(PYRROLIDIN-3-YL)BENZAMIDE HYDROCHLORIDE

N-ETHYL-N-METHYL-3-(PYRROLIDIN-3-YL)BENZAMIDE HYDROCHLORIDE

C14H21ClN2O (268.1342326)


   

ethyl 2-amino-4-(2-cyclopentylethyl)-1,3-thiazole-5-carboxylate

ethyl 2-amino-4-(2-cyclopentylethyl)-1,3-thiazole-5-carboxylate

C13H20N2O2S (268.124542)


   

2-butoxy-2-phenylacetophenone

2-butoxy-2-phenylacetophenone

C18H20O2 (268.146322)


   
   

CIS-1,4-DIBENZYLOXY-2-BUTENE

CIS-1,4-DIBENZYLOXY-2-BUTENE

C18H20O2 (268.146322)


   

3-(4-Hydroxyphenyl)-1,1,3-trimethyl-5-indanol

3-(4-Hydroxyphenyl)-1,1,3-trimethyl-5-indanol

C18H20O2 (268.146322)


   

Benzenesulfonamide,4-amino-N-cyclohexyl-N-methyl-

Benzenesulfonamide,4-amino-N-cyclohexyl-N-methyl-

C13H20N2O2S (268.124542)


   

4-(1,3-benzodioxol-5-yl)-2,3,4,5-tetrahydro-1H-1,5-benzodiazepine

4-(1,3-benzodioxol-5-yl)-2,3,4,5-tetrahydro-1H-1,5-benzodiazepine

C16H16N2O2 (268.12117159999997)


   

1-dodecanesulfonyl chloride

1-dodecanesulfonyl chloride

C12H25ClO2S (268.12637)


   

5-(Hexamethyleneimin-1-yl)-2-methylsulfonylaniline

5-(Hexamethyleneimin-1-yl)-2-methylsulfonylaniline

C13H20N2O2S (268.124542)


   

3-(3-Methylpiperidin-1-yl)-4-methylsulfonylaniline

3-(3-Methylpiperidin-1-yl)-4-methylsulfonylaniline

C13H20N2O2S (268.124542)


   
   

tert-butyl N-[(5,6-dimethoxypyridin-2-yl)methyl]carbamate

tert-butyl N-[(5,6-dimethoxypyridin-2-yl)methyl]carbamate

C13H20N2O4 (268.14230000000003)


   

2-METHYLIDENE-1,4-DIMORPHOLINOBUTANE-1,4-DIONE

2-METHYLIDENE-1,4-DIMORPHOLINOBUTANE-1,4-DIONE

C13H20N2O4 (268.14230000000003)


   
   

4-(1,1-Difluoroethyl)phenylboronic Acid Pinacol Ester

4-(1,1-Difluoroethyl)phenylboronic Acid Pinacol Ester

C14H19BF2O2 (268.1446088)


   

7-(tert-butoxycarbonyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyrazine-2-carboxylic acid

7-(tert-butoxycarbonyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyrazine-2-carboxylic acid

C11H16N4O4 (268.1171496)


   
   

tert-butyl 1,3-dioxo-2,7-diazaspiro[4.5]decane-7-carboxylate

tert-butyl 1,3-dioxo-2,7-diazaspiro[4.5]decane-7-carboxylate

C13H20N2O4 (268.14230000000003)


   

[2-(4-fluoro-phenyl)-2-hydroxyimino-ethyl]-carbamic acid tert-butyl ester

[2-(4-fluoro-phenyl)-2-hydroxyimino-ethyl]-carbamic acid tert-butyl ester

C13H17FN2O3 (268.12231440000005)


   

2-(2-phenylpyrrolidin-1-yl)pyridine-3-carboxylic acid

2-(2-phenylpyrrolidin-1-yl)pyridine-3-carboxylic acid

C16H16N2O2 (268.12117159999997)


   

n,n-bis(salicylidene)ethylenediamine

n,n-bis(salicylidene)ethylenediamine

C16H16N2O2 (268.12117159999997)


   
   

Benzenebutanoic acid, a-phenyl-, ethyl ester

Benzenebutanoic acid, a-phenyl-, ethyl ester

C18H20O2 (268.146322)


   
   

2-(2-Biphenylyloxy)ethyl acrylate

2-(2-Biphenylyloxy)ethyl acrylate

C17H16O3 (268.10993859999996)


   

1-[4-(3-METHYL-4-ISOPROPYL-PHENOXY)-PHENYL]-ETHANONE

1-[4-(3-METHYL-4-ISOPROPYL-PHENOXY)-PHENYL]-ETHANONE

C18H20O2 (268.146322)


   

1-[4-(3-TERT-BUTYL-PHENOXY)-PHENYL]-ETHANONE

1-[4-(3-TERT-BUTYL-PHENOXY)-PHENYL]-ETHANONE

C18H20O2 (268.146322)


   
   

4-(2,4,6-trimethylbenzoyl)benzoic acid

4-(2,4,6-trimethylbenzoyl)benzoic acid

C17H16O3 (268.10993859999996)


   

Benzene,(2,3-diphenyl-1-cyclopropen-1-yl)-

Benzene,(2,3-diphenyl-1-cyclopropen-1-yl)-

C21H16 (268.1251936)


   

1,1-bis(4-methoxyphenyl)prop-2-yn-1-ol

1,1-bis(4-methoxyphenyl)prop-2-yn-1-ol

C17H16O3 (268.10993859999996)


   

2-CHLORO-N-(2,2,6,6-TETRAMETHYLPIPERIDIN-4-YL)ACETAMIDE HYDROCHLORIDE

2-CHLORO-N-(2,2,6,6-TETRAMETHYLPIPERIDIN-4-YL)ACETAMIDE HYDROCHLORIDE

C11H22Cl2N2O (268.1109102)


   

2-benzhydryloxyoxane

2-benzhydryloxyoxane

C18H20O2 (268.146322)


   

ethyl 3-(3-biphenyl)-3-oxopropanoate

ethyl 3-(3-biphenyl)-3-oxopropanoate

C17H16O3 (268.10993859999996)


   

Benzoic acid,4-methyl-, 2-(4-methylbenzoyl)hydrazide

Benzoic acid,4-methyl-, 2-(4-methylbenzoyl)hydrazide

C16H16N2O2 (268.12117159999997)


   

2-amino-6-isopropyl-4,5,6,7-tetrahydro-thieno-[2,3-c]pyridine-3-carboxylic acid ethyl ester

2-amino-6-isopropyl-4,5,6,7-tetrahydro-thieno-[2,3-c]pyridine-3-carboxylic acid ethyl ester

C13H20N2O2S (268.124542)


   

4-(4-Thiazolyl)-1-piperidinecarboxylic acid 1,1-dimethylethyl ester

4-(4-Thiazolyl)-1-piperidinecarboxylic acid 1,1-dimethylethyl ester

C13H20N2O2S (268.124542)


   

6-Benzyl-5,6,7,8-tetrahydro-1,6-naphthyridine-2-carboxylic acid

6-Benzyl-5,6,7,8-tetrahydro-1,6-naphthyridine-2-carboxylic acid

C16H16N2O2 (268.12117159999997)


   

2-(BENZYLOXY)-5-(TERT-BUTYL)BENZALDEHYDE

2-(BENZYLOXY)-5-(TERT-BUTYL)BENZALDEHYDE

C18H20O2 (268.146322)


   

diethyl 1-amino-3-isopropyl-1H-pyrrole-2,4-dicarboxylate

diethyl 1-amino-3-isopropyl-1H-pyrrole-2,4-dicarboxylate

C13H20N2O4 (268.14230000000003)


   

Cyclohexyl(diphenyl)phosphine

Cyclohexyl(diphenyl)phosphine

C18H21P (268.1380796)


   

3,4,4-trimethyl-1-(4-methylphenyl)sulfonylimidazolidine

3,4,4-trimethyl-1-(4-methylphenyl)sulfonylimidazolidine

C13H20N2O2S (268.124542)


   

Methyl 3-(2-methoxyphenyl)-2-phenylacrylate

Methyl 3-(2-methoxyphenyl)-2-phenylacrylate

C17H16O3 (268.10993859999996)


   
   

Benzenebutanoic acid, g-oxo-4-(phenylmethyl)-

Benzenebutanoic acid, g-oxo-4-(phenylmethyl)-

C17H16O3 (268.10993859999996)


   

3-Fluoro-4-(octyloxy)benzoic acid

3-Fluoro-4-(octyloxy)benzoic acid

C15H21FO3 (268.14746479999997)


   
   

2-Methyl-1,4-bis(trimethylsiloxy)benzene

2-Methyl-1,4-bis(trimethylsiloxy)benzene

C13H24O2Si2 (268.1314764)


   

4-octyloxybenzoyl chloride

4-octyloxybenzoyl chloride

C15H21ClO2 (268.1229996)


   

2-benzyl-6-nitro-1,2,3,4-tetrahydroisoquinoline

2-benzyl-6-nitro-1,2,3,4-tetrahydroisoquinoline

C16H16N2O2 (268.12117159999997)


   

N-Phenyldiethanolamine 2-pyridylboronate

N-Phenyldiethanolamine 2-pyridylboronate

C15H17BN2O2 (268.1383012)


   

tert-Butyl 3-(thien-2-yl)piperazine-1-carboxylate, 1-(tert-Butoxycarbonyl)-3-(thien-2-yl)piperazine

tert-Butyl 3-(thien-2-yl)piperazine-1-carboxylate, 1-(tert-Butoxycarbonyl)-3-(thien-2-yl)piperazine

C13H20N2O2S (268.124542)


   

(Z)-4,4-(hex-3-ene-3,4-diyl)diphenol

(Z)-4,4-(hex-3-ene-3,4-diyl)diphenol

C18H20O2 (268.146322)


   

2-(4-ETHOXY-PHENYL)-6-METHYL-2H-BENZOTRIAZOL-5-YLAMINE

2-(4-ETHOXY-PHENYL)-6-METHYL-2H-BENZOTRIAZOL-5-YLAMINE

C15H16N4O (268.1324046)


   

4,4-ethylenedipiperidine dihydrochloride

4,4-ethylenedipiperidine dihydrochloride

C12H26Cl2N2 (268.1472936)


   

5-Benzyloxy-6-methoxy-1-indanone

5-Benzyloxy-6-methoxy-1-indanone

C17H16O3 (268.10993859999996)


   

TRANS-N-P-TOLYLSULFONYL-1,2-DIAMINOCYCLOHEXANE

TRANS-N-P-TOLYLSULFONYL-1,2-DIAMINOCYCLOHEXANE

C13H20N2O2S (268.124542)


   

4-(4-n-Pentylphenyl)benzoic acid

4-(4-n-Pentylphenyl)benzoic acid

C18H20O2 (268.146322)


   

ethyl prop-2-enoate,N-(hydroxymethyl)-2-methylprop-2-enamide,prop-2-enenitrile

ethyl prop-2-enoate,N-(hydroxymethyl)-2-methylprop-2-enamide,prop-2-enenitrile

C13H20N2O4 (268.14230000000003)


   

7-(4-METHOXYPHENYL)-5,6-DIMETHYL-7H-PYRROLO[2,3-D]PYRIMIDIN-4-AMINE

7-(4-METHOXYPHENYL)-5,6-DIMETHYL-7H-PYRROLO[2,3-D]PYRIMIDIN-4-AMINE

C15H16N4O (268.1324046)


   

ethyl 3-(4-biphenyl)-3-oxopropanoate

ethyl 3-(4-biphenyl)-3-oxopropanoate

C17H16O3 (268.10993859999996)


   

7-(TERT-BUTOXYCARBONYL)-5,6,7,8-TETRAHYDRO-[1,2,4]TRIAZOLO[4,3-A]PYRAZINE-3-CARBOXYLIC ACID

7-(TERT-BUTOXYCARBONYL)-5,6,7,8-TETRAHYDRO-[1,2,4]TRIAZOLO[4,3-A]PYRAZINE-3-CARBOXYLIC ACID

C11H16N4O4 (268.1171496)


   

1-Ethyl-4-[(4-methylphenyl)sulfonyl]piperazine

1-Ethyl-4-[(4-methylphenyl)sulfonyl]piperazine

C13H20N2O2S (268.124542)


   

benzoin isobutyl ether

benzoin isobutyl ether

C18H20O2 (268.146322)


   

N-Ethyl-N-methyl-3-(3-pyrrolidinyl)benzamide hydrochloride (1:1)

N-Ethyl-N-methyl-3-(3-pyrrolidinyl)benzamide hydrochloride (1:1)

C14H21ClN2O (268.1342326)


   

(R)-2-Methyl-1,1-binaphthalene

(R)-2-Methyl-1,1-binaphthalene

C21H16 (268.1251936)


   

4-aminobutyl-4-hydroxy-3,5-dimethoxybenzoate

4-aminobutyl-4-hydroxy-3,5-dimethoxybenzoate

C13H18NO5- (268.1184918)


   

cis-3-(Boc-aMino)-5-(trifluorMethyl)piperidine

cis-3-(Boc-aMino)-5-(trifluorMethyl)piperidine

C11H19F3N2O2 (268.13985499999995)


   

tert-butyl N-[(3R,5S)-5-(trifluoromethyl)piperidin-3-yl]carbamate

tert-butyl N-[(3R,5S)-5-(trifluoromethyl)piperidin-3-yl]carbamate

C11H19F3N2O2 (268.13985499999995)


   

5-Cyanoindole-2-boronic acid, pinacol ester

5-Cyanoindole-2-boronic acid, pinacol ester

C15H17BN2O2 (268.1383012)


   

Phenanthrene,9-methyl-10-phenyl-

Phenanthrene,9-methyl-10-phenyl-

C21H16 (268.1251936)


   

methyltris(2-methoxyethoxy)silane

methyltris(2-methoxyethoxy)silane

C10H24O6Si (268.1342084)


   

ethyl N-(3-fluoro-4-morpholin-4-ylphenyl)carbamate

ethyl N-(3-fluoro-4-morpholin-4-ylphenyl)carbamate

C13H17FN2O3 (268.12231440000005)


   

(1R,2R)-(+)-N-(4-TOLUENESULPHONYL)-1,2-DIAMINOCYCLOHEXANE

(1R,2R)-(+)-N-(4-TOLUENESULPHONYL)-1,2-DIAMINOCYCLOHEXANE

C13H20N2O2S (268.124542)


   

2-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indole-4-carbonitrile

2-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indole-4-carbonitrile

C15H17BN2O2 (268.1383012)


   

Poly(oxy-1,2-ethanediyl),a-(1-oxo-2-propen-1-yl)-w-([1,1-biphenyl]-2-yloxy)

Poly(oxy-1,2-ethanediyl),a-(1-oxo-2-propen-1-yl)-w-([1,1-biphenyl]-2-yloxy)

C17H16O3 (268.10993859999996)


   
   

4-[(2S)-2-Methylbutyl]-[1,1-biphenyl]-4-carboxylic acid

4-[(2S)-2-Methylbutyl]-[1,1-biphenyl]-4-carboxylic acid

C18H20O2 (268.146322)


   

5,6-DIMETHOXY-2-PHENYL-INDAN-1-ONE

5,6-DIMETHOXY-2-PHENYL-INDAN-1-ONE

C17H16O3 (268.10993859999996)


   

4-METHYL-N-(2-(PYRROLIDIN-1-YL)ETHYL)BENZENESULFONAMIDE

4-METHYL-N-(2-(PYRROLIDIN-1-YL)ETHYL)BENZENESULFONAMIDE

C13H20N2O2S (268.124542)


   

1-METHYL-3,4-DIHYDROSPIRO[CHROMENE-2,4-PIPERIDIN]-4-AMINE HYDROCHLORIDE

1-METHYL-3,4-DIHYDROSPIRO[CHROMENE-2,4-PIPERIDIN]-4-AMINE HYDROCHLORIDE

C14H21ClN2O (268.1342326)


   

tert-Butyl-4-(methyl)biphenyl-2-carboxylate

tert-Butyl-4-(methyl)biphenyl-2-carboxylate

C18H20O2 (268.146322)


   

diethyl 2-[(4-fluorophenyl)methyl]propanedioate

diethyl 2-[(4-fluorophenyl)methyl]propanedioate

C14H17FO4 (268.11108140000005)


   

4-Acetylamino-2-(bis(2-hydroxyethyl)amino)anisole

4-Acetylamino-2-(bis(2-hydroxyethyl)amino)anisole

C13H20N2O4 (268.14230000000003)


   
   
   

4-Dimethylamino-4-nitrostilbene

4-Dimethylamino-4′-nitrostilbene

C16H16N2O2 (268.12117159999997)


   

METHYL 2-(3-(BENZYLOXY)PHENYL)ACRYLATE

METHYL 2-(3-(BENZYLOXY)PHENYL)ACRYLATE

C17H16O3 (268.10993859999996)


   

1-tert-Butyl 4-methyl 4-cyanopiperidine-1,4-dicarboxylate

1-tert-Butyl 4-methyl 4-cyanopiperidine-1,4-dicarboxylate

C13H20N2O4 (268.14230000000003)


   

1-(4-METHOXY-PHENYL)-4-PHENYL-BUTANE-1,4-DIONE

1-(4-METHOXY-PHENYL)-4-PHENYL-BUTANE-1,4-DIONE

C17H16O3 (268.10993859999996)


   

7-Oxabicyclo[2.2.1]heptane-2-carboxylic acid, 3-[(4-methyl-1-piperazinyl)carbonyl]-, (1R,4S)-rel-

7-Oxabicyclo[2.2.1]heptane-2-carboxylic acid, 3-[(4-methyl-1-piperazinyl)carbonyl]-, (1R,4S)-rel-

C13H20N2O4 (268.14230000000003)


D000970 - Antineoplastic Agents D004791 - Enzyme Inhibitors C471 - Enzyme Inhibitor

   

Ornithine phenylacetate

Ornithine phenylacetate

C13H20N2O4 (268.14230000000003)


C78275 - Agent Affecting Blood or Body Fluid

   

1,2-Dinaphthylmethane

1,2-Dinaphthylmethane

C21H16 (268.1251936)


   
   

5-methyl-N-(4,5,6-trimethylpyrimidin-2-yl)-1,3-benzoxazol-2-amine

5-methyl-N-(4,5,6-trimethylpyrimidin-2-yl)-1,3-benzoxazol-2-amine

C15H16N4O (268.1324046)


   

4,4-Propane-1,3-diyldipiperazine-2,6-dione

4,4-Propane-1,3-diyldipiperazine-2,6-dione

C11H16N4O4 (268.1171496)


   

4-[(3-Methylphenoxy)methyl]-2-phenyl-1,3,2-dioxaborolane

4-[(3-Methylphenoxy)methyl]-2-phenyl-1,3,2-dioxaborolane

C16H17BO3 (268.12706820000005)


   

Benzeneboronic acid, cyclic ((p-tolyloxy)methyl)ethylene ester

Benzeneboronic acid, cyclic ((p-tolyloxy)methyl)ethylene ester

C16H17BO3 (268.12706820000005)


   
   

5,5,6,6-Tetramethyl-5,6-dihydrodibenzo[c,e][1,2]disiline

5,5,6,6-Tetramethyl-5,6-dihydrodibenzo[c,e][1,2]disiline

C16H20Si2 (268.11034800000004)


   

Benzeneacetic acid, 3,4-dimethoxy-, trimethylsilyl ester

Benzeneacetic acid, 3,4-dimethoxy-, trimethylsilyl ester

C13H20O4Si (268.11308)


   

Methyl (3-methoxyphenyl)[(trimethylsilyl)oxy]acetate

Methyl (3-methoxyphenyl)[(trimethylsilyl)oxy]acetate

C13H20O4Si (268.11308)


   

5-Methyl-5-(trimethylsilyl)-5H-dibenzo[b,d]silole

5-Methyl-5-(trimethylsilyl)-5H-dibenzo[b,d]silole

C16H20Si2 (268.11034800000004)


   

Acetic acid, [3-methoxy-4-(trimethylsiloxy)phenyl]-, methyl ester

Acetic acid, [3-methoxy-4-(trimethylsiloxy)phenyl]-, methyl ester

C13H20O4Si (268.11308)


   

Benzeneacetic acid, 4-methoxy-alpha-[(trimethylsilyl)oxy]-, methyl ester

Benzeneacetic acid, 4-methoxy-alpha-[(trimethylsilyl)oxy]-, methyl ester

C13H20O4Si (268.11308)


   

Methyl (2-methoxyphenyl)[(trimethylsilyl)oxy]acetate

Methyl (2-methoxyphenyl)[(trimethylsilyl)oxy]acetate

C13H20O4Si (268.11308)


   

2-Amino-7-[2-(2-hydroxy-1-hydroxymethyl-ethylamino)-ethyl]-1,7-dihydro-purin-6-one

2-Amino-7-[2-(2-hydroxy-1-hydroxymethyl-ethylamino)-ethyl]-1,7-dihydro-purin-6-one

C10H16N6O3 (268.1283826)


   

3,6-Diphenylcyclohexan-1,2-diol

3,6-Diphenylcyclohexan-1,2-diol

C18H20O2 (268.146322)


   

3-(2-Hydroxyphenyl)-1-phenylpentane-1,4-dione

3-(2-Hydroxyphenyl)-1-phenylpentane-1,4-dione

C17H16O3 (268.10993859999996)


   

(2Z)-2-cyano-3-(2,3,6,7-tetrahydro-1H,5H-pyrido[3,2,1-ij]quinolin-9-yl)acrylic acid

(2Z)-2-cyano-3-(2,3,6,7-tetrahydro-1H,5H-pyrido[3,2,1-ij]quinolin-9-yl)acrylic acid

C16H16N2O2 (268.12117159999997)


   

Acetylcarnosine

N-Acetyl-L-carnosine

C11H16N4O4 (268.1171496)


N-Acetylcarnosine, a natural histidine-containing dipeptide, is a source of pharmacological principal L-carnosine. N-Acetylcarnosine is a potent ophthalmic agent in human cataracts[1].

   

6-Dehydroestrone

3-Hydroxyestra-1,3,5(10),6-tetraen-17-one

C18H20O2 (268.146322)


   

17alpha-Dihydroequilin

17alpha-Dihydroequilenin

C18H20O2 (268.146322)


   

Cyanotriphenylborate

Cyanotriphenylborate

C19H15BN- (268.129748)


   

Dihydroxy Melphatalan-d8

4-Bis(2-hydroxyethyl)amino-L-phenylalanine

C13H20N2O4 (268.14230000000003)


D000970 - Antineoplastic Agents > D018906 - Antineoplastic Agents, Alkylating > D009588 - Nitrogen Mustard Compounds

   

N-(1,8-dimethyl-3-pyrazolo[3,4-b]quinolinyl)propanamide

N-(1,8-dimethyl-3-pyrazolo[3,4-b]quinolinyl)propanamide

C15H16N4O (268.1324046)


   

N-(3-methoxyphenyl)-N-[(3-methoxyphenyl)methylidene]methanimidamide

N-(3-methoxyphenyl)-N-[(3-methoxyphenyl)methylidene]methanimidamide

C16H16N2O2 (268.12117159999997)


   

2,2-dimethyl-N-pyridin-4-yl-3H-benzofuran-7-carboxamide

2,2-dimethyl-N-pyridin-4-yl-3H-benzofuran-7-carboxamide

C16H16N2O2 (268.12117159999997)


   

2-Butoxy-7-hydroxy-9-fluorenone

2-Butoxy-7-hydroxy-9-fluorenone

C17H16O3 (268.10993859999996)


   

3-(2-Hydroxyphenyl)-1,1,3-trimethyl-5-indanol

3-(2-Hydroxyphenyl)-1,1,3-trimethyl-5-indanol

C18H20O2 (268.146322)


   

4,6-dimethyl-N-[(E)-1-phenylethylideneamino]pyrimidine-2-carboxamide

4,6-dimethyl-N-[(E)-1-phenylethylideneamino]pyrimidine-2-carboxamide

C15H16N4O (268.1324046)


   

Histidinyl-hydroxyproline

Histidinyl-hydroxyproline

C11H16N4O4 (268.1171496)


   

5-[[2-Furanylmethyl(methyl)amino]methyl]-8-quinolinol

5-[[2-Furanylmethyl(methyl)amino]methyl]-8-quinolinol

C16H16N2O2 (268.12117159999997)


   

(2,6-Dimethylmorpholin-4-yl)-(1-methyl-5-nitropyrazol-4-yl)methanone

(2,6-Dimethylmorpholin-4-yl)-(1-methyl-5-nitropyrazol-4-yl)methanone

C11H16N4O4 (268.1171496)


   

N-(oxolan-2-ylmethyl)-5H-pyrimido[5,4-b]indol-4-amine

N-(oxolan-2-ylmethyl)-5H-pyrimido[5,4-b]indol-4-amine

C15H16N4O (268.1324046)


   

6-[(4-hydroxybutyl)amino]-5-[(E)-(2-oxopropylidene)amino]pyrimidine-2,4(1H,3H)-dione

6-[(4-hydroxybutyl)amino]-5-[(E)-(2-oxopropylidene)amino]pyrimidine-2,4(1H,3H)-dione

C11H16N4O4 (268.1171496)


   

N-butyl-N(2)-(2-thienylacetyl)-L-alaninamide

N-butyl-N(2)-(2-thienylacetyl)-L-alaninamide

C13H20N2O2S (268.124542)


   

(9R,13S,14R)-3-hydroxy-13-methyl-9,11,12,14,15,16-hexahydro-6H-cyclopenta[a]phenanthren-17-one

(9R,13S,14R)-3-hydroxy-13-methyl-9,11,12,14,15,16-hexahydro-6H-cyclopenta[a]phenanthren-17-one

C18H20O2 (268.146322)


   

2-Hydroxy-4-methoxy-5-methylchalcone

2-Hydroxy-4-methoxy-5-methylchalcone

C17H16O3 (268.10993859999996)


   

4-Tert-butylbenzyl benzoate

4-Tert-butylbenzyl benzoate

C18H20O2 (268.146322)


   

3,5-Dimethoxyphenylacetic acid, trimethylsilyl ester

3,5-Dimethoxyphenylacetic acid, trimethylsilyl ester

C13H20O4Si (268.11308)


   

2,3-Dimethoxyphenylacetic acid, trimethylsilyl ester

2,3-Dimethoxyphenylacetic acid, trimethylsilyl ester

C13H20O4Si (268.11308)


   

4-Hydroxy-6,8-dimethylflavanone

4-Hydroxy-6,8-dimethylflavanone

C17H16O3 (268.10993859999996)


   

2-Hydroxy-5,7-dimethylflavanone

2-Hydroxy-5,7-dimethylflavanone

C17H16O3 (268.10993859999996)


   

4,4,5,5-Tetracyano-1-trimethylsilylmethylcyclohexene

4,4,5,5-Tetracyano-1-trimethylsilylmethylcyclohexene

C14H16N4Si (268.11441759999997)


   

Acetophenone 2-methoxycarbonylphenylhydrazone

Acetophenone 2-methoxycarbonylphenylhydrazone

C16H16N2O2 (268.12117159999997)


   

2,5-Dimethoxyphenylacetic acid trimethylsilyl ester

2,5-Dimethoxyphenylacetic acid trimethylsilyl ester

C13H20O4Si (268.11308)


   

(R)-2-Methylbutyric acid (S)-1,5-dimethyl-2-oxo-4-methoxy-6-hydroxy-3,5-cyclohexadienyl ester

(R)-2-Methylbutyric acid (S)-1,5-dimethyl-2-oxo-4-methoxy-6-hydroxy-3,5-cyclohexadienyl ester

C14H20O5 (268.13106700000003)


   

(+)-Lysergic acid

6-Methyl-9,10-didehydroergoline-8-carboxylic acid

C16H16N2O2 (268.12117159999997)


   

2,3-Dihydro-1H-benzo(a)cyclopent(H)anthracene

2,3-Dihydro-1H-benzo(a)cyclopent(H)anthracene

C21H16 (268.1251936)


   

4,4-Cyclohexylidenebisphenol

1,1-Bis(4-hydroxyphenyl)cyclohexane

C18H20O2 (268.146322)


   

3-methylcholanthrene

3-methylcholanthrene

C21H16 (268.1251936)


   

2-(2-carboxyethyl)-4-methyl-5-pentylfuran-3-carboxylic acid

2-(2-carboxyethyl)-4-methyl-5-pentylfuran-3-carboxylic acid

C14H20O5 (268.13106700000003)


   

Cimetidine sulfoxide

Cimetidine sulfoxide

C10H16N6OS (268.1106246)


Cimetidine sulfoxide (Cimetidine sulphoxide) is a sulfoxide metabolite of Cimetidine. Cimetidine is a histamine H2-receptor antagonist. Cimetidine has the potential for peptic ulcer disease and upper gastrointestinal haemorrhage treatment[1].

   

Hydroxyprolyl-Histidine

Hydroxyprolyl-Histidine

C11H16N4O4 (268.1171496)


   

3-hydroxy-13-methyl-9,11,12,14,15,16-hexahydro-6H-cyclopenta[a]phenanthren-17-one

3-hydroxy-13-methyl-9,11,12,14,15,16-hexahydro-6H-cyclopenta[a]phenanthren-17-one

C18H20O2 (268.146322)


   

(E)-octadeca-15,17-dien-9,11,13-triynoic acid

(E)-octadeca-15,17-dien-9,11,13-triynoic acid

C18H20O2 (268.146322)


   

Carboxymethylpentylfuranpropanoic acid

Carboxymethylpentylfuranpropanoic acid

C14H20O5 (268.13106700000003)


   

DMeOB

DMeOB

C16H16N2O2 (268.12117159999997)


DMeOB is an agonist of mGluR5 receptor with an IC50 of 3 μM. DMeOB has a negative modulatory effect[1].

   

3-carboxy-4-methyl-5-pentyl-2-furanpropionate (3-CMPFP)

new_metabolite-834158

C14H20O5 (268.131067)


Belongs to the class of organic compounds known as furanoid fatty acids. These are fatty acids containing a 5-alkylfuran-2-alkanoic acid

   

3-carboxy-4-methyl-5-pentyl-2-furanpropanoic acid

2-(2-carboxyethyl)-4-methyl-5-pentylfuran-3-carboxylic acid

C14H20O5 (268.131067)


Belongs to the class of organic compounds known as furanoid fatty acids. These are fatty acids containing a 5-alkylfuran-2-alkanoic acid.

   

8a-hydroxy-3,3,6,6,8,8-hexamethyl-1,2-benzodioxine-5,7-dione

8a-hydroxy-3,3,6,6,8,8-hexamethyl-1,2-benzodioxine-5,7-dione

C14H20O5 (268.13106700000003)


   

(5ar,11ar)-5a,11a-dimethyl-6,12-dihydro-5,11-dioxa-6,12-diazatetracene

(5ar,11ar)-5a,11a-dimethyl-6,12-dihydro-5,11-dioxa-6,12-diazatetracene

C16H16N2O2 (268.12117159999997)


   

(8s)-3-[(2r,4s,5r)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-4h,7h,8h-imidazo[4,5-d][1,3]diazepin-8-ol

(8s)-3-[(2r,4s,5r)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-4h,7h,8h-imidazo[4,5-d][1,3]diazepin-8-ol

C11H16N4O4 (268.1171496)


   

2-methyl-6-(2-phenylethoxy)oxane-3,4,5-triol

2-methyl-6-(2-phenylethoxy)oxane-3,4,5-triol

C14H20O5 (268.13106700000003)


   

(3r,4'r)-4',6-dimethylspiro[naphtho[1,2-c]furan-3,2'-oxolan]-1-one

(3r,4'r)-4',6-dimethylspiro[naphtho[1,2-c]furan-3,2'-oxolan]-1-one

C17H16O3 (268.10993859999996)


   

(2s,3s)-2-[(1z,3s)-3-hydroxyhept-1-en-1-yl]-6-oxo-2,3-dihydropyran-3-yl acetate

(2s,3s)-2-[(1z,3s)-3-hydroxyhept-1-en-1-yl]-6-oxo-2,3-dihydropyran-3-yl acetate

C14H20O5 (268.13106700000003)


   

(1s,2s,3r)-3-acetyl-2-(4-carboxy-4-methylbut-3-en-1-yl)-2-methylcyclobutane-1-carboxylic acid

(1s,2s,3r)-3-acetyl-2-(4-carboxy-4-methylbut-3-en-1-yl)-2-methylcyclobutane-1-carboxylic acid

C14H20O5 (268.13106700000003)


   

10-hydroxy-4,4,8-trimethyl-1h,2h,3h-cyclohepta[a]naphthalen-9-one

10-hydroxy-4,4,8-trimethyl-1h,2h,3h-cyclohepta[a]naphthalen-9-one

C18H20O2 (268.146322)


   

{4-[(2r)-1,2-dihydroxypropan-2-yl]-3-hydroxyphenyl}methyl 2-methylpropanoate

{4-[(2r)-1,2-dihydroxypropan-2-yl]-3-hydroxyphenyl}methyl 2-methylpropanoate

C14H20O5 (268.13106700000003)


   

(3r,4as,6r)-6,8-dihydroxy-3-(4-oxopentyl)-3,4,4a,5,6,7-hexahydro-2-benzopyran-1-one

(3r,4as,6r)-6,8-dihydroxy-3-(4-oxopentyl)-3,4,4a,5,6,7-hexahydro-2-benzopyran-1-one

C14H20O5 (268.13106700000003)


   

(2s)-4-acetyl-2-[(1e,5s)-5-hydroxyhex-1-en-1-yl]-5-methoxy-2-methylfuran-3-one

(2s)-4-acetyl-2-[(1e,5s)-5-hydroxyhex-1-en-1-yl]-5-methoxy-2-methylfuran-3-one

C14H20O5 (268.13106700000003)


   

1,3-bis(4-hydroxyphenyl)pent-4-en-1-one

1,3-bis(4-hydroxyphenyl)pent-4-en-1-one

C17H16O3 (268.10993859999996)


   

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

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

C18H20O2 (268.146322)


   

(2z,5e)-5-(1h-indol-3-ylmethylidene)-1,3-dimethyl-2-(methylimino)imidazolidin-4-one

(2z,5e)-5-(1h-indol-3-ylmethylidene)-1,3-dimethyl-2-(methylimino)imidazolidin-4-one

C15H16N4O (268.1324046)


   

(11s)-5-hydroxy-6,12,12-trimethyltricyclo[9.4.0.0³,⁸]pentadeca-1,3(8),4,6,14-pentaen-9-one

(11s)-5-hydroxy-6,12,12-trimethyltricyclo[9.4.0.0³,⁸]pentadeca-1,3(8),4,6,14-pentaen-9-one

C18H20O2 (268.146322)


   

4',6-dimethylspiro[naphtho[1,2-c]furan-3,2'-oxolan]-1-one

4',6-dimethylspiro[naphtho[1,2-c]furan-3,2'-oxolan]-1-one

C17H16O3 (268.10993859999996)


   

methyl 2-hydroxy-3-[4-hydroxy-2,5-bis(prop-1-en-1-yl)oxolan-3-ylidene]propanoate

methyl 2-hydroxy-3-[4-hydroxy-2,5-bis(prop-1-en-1-yl)oxolan-3-ylidene]propanoate

C14H20O5 (268.13106700000003)


   

methyl (2r)-2-hydroxy-3-[(2r,3e,4s,5s)-4-hydroxy-2,5-bis[(1e)-prop-1-en-1-yl]oxolan-3-ylidene]propanoate

methyl (2r)-2-hydroxy-3-[(2r,3e,4s,5s)-4-hydroxy-2,5-bis[(1e)-prop-1-en-1-yl]oxolan-3-ylidene]propanoate

C14H20O5 (268.13106700000003)


   

4-[2-(4-hydroxy-2-methyl-5-oxooxolan-2-yl)ethyl]-3-propyl-5h-furan-2-one

4-[2-(4-hydroxy-2-methyl-5-oxooxolan-2-yl)ethyl]-3-propyl-5h-furan-2-one

C14H20O5 (268.13106700000003)


   

butyl 3-(2,4-dihydroxy-5-methoxyphenyl)propanoate

butyl 3-(2,4-dihydroxy-5-methoxyphenyl)propanoate

C14H20O5 (268.13106700000003)


   

(4ar,5s,7r,8r)-8-chloro-7-hydroxy-4a,5-dimethyl-3-(propan-2-ylidene)-5,6,7,8-tetrahydro-4h-naphthalen-2-one

(4ar,5s,7r,8r)-8-chloro-7-hydroxy-4a,5-dimethyl-3-(propan-2-ylidene)-5,6,7,8-tetrahydro-4h-naphthalen-2-one

C15H21ClO2 (268.1229996)


   

1,3-di-p-hydroxyphenyl-4-penten-1-one

NA

C17H16O3 (268.10993859999996)


{"Ingredient_id": "HBIN001225","Ingredient_name": "1,3-di-p-hydroxyphenyl-4-penten-1-one","Alias": "NA","Ingredient_formula": "C17H16O3","Ingredient_Smile": "C=CC(CC(=O)C1=CC=C(C=C1)O)C2=CC=C(C=C2)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "6089","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   

1-deoxy-l-erythritol 3-o-β-d-glucopyranoside

NA

C10H20O8 (268.115812)


{"Ingredient_id": "HBIN002485","Ingredient_name": "1-deoxy-l-erythritol 3-o-\u03b2-d-glucopyranoside","Alias": "NA","Ingredient_formula": "C10H20O8","Ingredient_Smile": "CC(C(CO)OC1C(C(C(C(O1)CO)O)O)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "5171","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   

3-(hydroxymethyl)-2,5-bis(3-methylbut-3-en-1-ynyl)benzene-1,4-diol

NA

C17H16O3 (268.10993859999996)


{"Ingredient_id": "HBIN008724","Ingredient_name": "3-(hydroxymethyl)-2,5-bis(3-methylbut-3-en-1-ynyl)benzene-1,4-diol","Alias": "NA","Ingredient_formula": "C17H16O3","Ingredient_Smile": "CC(=C)C#CC1=CC(=C(C(=C1O)CO)C#CC(=C)C)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "10468","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   

7,8-dihydroxy-isobutyryl-thymol

NA

C14H20O5 (268.13106700000003)


{"Ingredient_id": "HBIN012986","Ingredient_name": "7,8-dihydroxy-isobutyryl-thymol","Alias": "NA","Ingredient_formula": "C14H20O5","Ingredient_Smile": "CC(C)C(=O)OCC(C)(C1=C(C=C(C=C1)CO)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "5920","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   

9,10-dihydro-3,7-dihydroxy-2,8-dimethyl-4-phenanthrenecarboxaldehyde

NA

C17H16O3 (268.10993859999996)


{"Ingredient_id": "HBIN013936","Ingredient_name": "9,10-dihydro-3,7-dihydroxy-2,8-dimethyl-4-phenanthrenecarboxaldehyde","Alias": "NA","Ingredient_formula": "C17H16O3","Ingredient_Smile": "NA","Ingredient_weight": "268.31","OB_score": "NA","CAS_id": "147850-88-2","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "7305","PubChem_id": "NA","DrugBank_id": "NA"}

   

beta-carboline-1-carboxylic acid; butyl ester

NA

C16H16N2O2 (268.12117159999997)


{"Ingredient_id": "HBIN018003","Ingredient_name": "beta-carboline-1-carboxylic acid; butyl ester","Alias": "NA","Ingredient_formula": "C16H16N2O2","Ingredient_Smile": "NA","Ingredient_weight": "268.31","OB_score": "NA","CAS_id": "153535-98-9","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "17","PubChem_id": "NA","DrugBank_id": "NA"}

   

(6r)-6-[(5e,8e)-9-chloro-8-methylnona-5,8-dien-1-yl]-5,6-dihydropyran-2-one

(6r)-6-[(5e,8e)-9-chloro-8-methylnona-5,8-dien-1-yl]-5,6-dihydropyran-2-one

C15H21ClO2 (268.1229996)


   

[6-(2-chloroethyl)-7-(hydroxymethyl)-2,2-dimethyl-1,3-dihydroinden-5-yl]methanol

[6-(2-chloroethyl)-7-(hydroxymethyl)-2,2-dimethyl-1,3-dihydroinden-5-yl]methanol

C15H21ClO2 (268.1229996)


   

ethyl 3-{9h-pyrido[3,4-b]indol-1-yl}propanoate

ethyl 3-{9h-pyrido[3,4-b]indol-1-yl}propanoate

C16H16N2O2 (268.12117159999997)


   

[1-(acetyloxy)-7-methyl-1h,4ah,5h,6h,7h,7ah-cyclopenta[c]pyran-4-yl]methyl acetate

[1-(acetyloxy)-7-methyl-1h,4ah,5h,6h,7h,7ah-cyclopenta[c]pyran-4-yl]methyl acetate

C14H20O5 (268.13106700000003)


   

4-methoxy-1,3-dimethyl-2,6-dioxocyclohex-3-en-1-yl 2-methylbutanoate

4-methoxy-1,3-dimethyl-2,6-dioxocyclohex-3-en-1-yl 2-methylbutanoate

C14H20O5 (268.13106700000003)


   

(1r,3s,6r,8e,10s)-6,10-dihydroxy-8-[(2s)-2-hydroxypropylidene]-4,4-dimethyl-5-oxatricyclo[4.4.0.0¹,³]decan-7-one

(1r,3s,6r,8e,10s)-6,10-dihydroxy-8-[(2s)-2-hydroxypropylidene]-4,4-dimethyl-5-oxatricyclo[4.4.0.0¹,³]decan-7-one

C14H20O5 (268.13106700000003)


   

5-hydroxy-7-methyl-2-(4-methylphenyl)-2,3-dihydro-1-benzopyran-4-one

5-hydroxy-7-methyl-2-(4-methylphenyl)-2,3-dihydro-1-benzopyran-4-one

C17H16O3 (268.10993859999996)


   

8-chloro-7-hydroxy-4a,5-dimethyl-3-(propan-2-ylidene)-5,6,7,8-tetrahydro-4h-naphthalen-2-one

8-chloro-7-hydroxy-4a,5-dimethyl-3-(propan-2-ylidene)-5,6,7,8-tetrahydro-4h-naphthalen-2-one

C15H21ClO2 (268.1229996)


   

(3s,5r,6r,6's)-5,6-dihydroxy-6,6'-dimethyl-4,5-dihydro-1h-spiro[cyclopenta[c]pyran-3,2'-oxan]-7-one

(3s,5r,6r,6's)-5,6-dihydroxy-6,6'-dimethyl-4,5-dihydro-1h-spiro[cyclopenta[c]pyran-3,2'-oxan]-7-one

C14H20O5 (268.13106700000003)


   

methyl (2r,5r,6r)-5-hydroxy-2-[(1s,2e)-1-hydroxybut-2-en-1-yl]-6-[(1e)-prop-1-en-1-yl]-5,6-dihydro-2h-pyran-3-carboxylate

methyl (2r,5r,6r)-5-hydroxy-2-[(1s,2e)-1-hydroxybut-2-en-1-yl]-6-[(1e)-prop-1-en-1-yl]-5,6-dihydro-2h-pyran-3-carboxylate

C14H20O5 (268.13106700000003)


   

(8r)-3-[(4r,5s)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-4h,7h,8h-imidazo[4,5-d][1,3]diazepin-8-ol

(8r)-3-[(4r,5s)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-4h,7h,8h-imidazo[4,5-d][1,3]diazepin-8-ol

C11H16N4O4 (268.1171496)


   

5-(1h-indol-3-ylmethylidene)-1,3-dimethyl-2-(methylimino)imidazolidin-4-one

5-(1h-indol-3-ylmethylidene)-1,3-dimethyl-2-(methylimino)imidazolidin-4-one

C15H16N4O (268.1324046)


   

12-hydroxy-6,14-dimethyl-1,7-dioxacyclotetradeca-3,9-diene-2,8-dione

12-hydroxy-6,14-dimethyl-1,7-dioxacyclotetradeca-3,9-diene-2,8-dione

C14H20O5 (268.13106700000003)


   

4-acetyl-2-(5-hydroxyhex-1-en-1-yl)-5-methoxy-2-methylfuran-3-one

4-acetyl-2-(5-hydroxyhex-1-en-1-yl)-5-methoxy-2-methylfuran-3-one

C14H20O5 (268.13106700000003)


   

(1r)-1-{6-[(1r)-1-hydroxyethyl]phenazin-1-yl}ethanol

(1r)-1-{6-[(1r)-1-hydroxyethyl]phenazin-1-yl}ethanol

C16H16N2O2 (268.12117159999997)


   

[(1r,4ar,7r,7as)-1-(acetyloxy)-7-methyl-1h,4ah,5h,6h,7h,7ah-cyclopenta[c]pyran-4-yl]methyl acetate

[(1r,4ar,7r,7as)-1-(acetyloxy)-7-methyl-1h,4ah,5h,6h,7h,7ah-cyclopenta[c]pyran-4-yl]methyl acetate

C14H20O5 (268.13106700000003)


   

1-benzylphenanthrene

1-benzylphenanthrene

C21H16 (268.1251936)


   

4-acetyl-2-[(1e)-5-hydroxyhex-1-en-1-yl]-5-methoxy-2-methylfuran-3-one

4-acetyl-2-[(1e)-5-hydroxyhex-1-en-1-yl]-5-methoxy-2-methylfuran-3-one

C14H20O5 (268.13106700000003)


   

2-[(1e)-1-{2-[1-(2-hydroxyphenyl)ethylidene]hydrazin-1-ylidene}ethyl]phenol

2-[(1e)-1-{2-[1-(2-hydroxyphenyl)ethylidene]hydrazin-1-ylidene}ethyl]phenol

C16H16N2O2 (268.12117159999997)


   

(1s,3r,6s,8e,10s)-6,10-dihydroxy-8-[(2s)-2-hydroxypropylidene]-4,4-dimethyl-5-oxatricyclo[4.4.0.0¹,³]decan-7-one

(1s,3r,6s,8e,10s)-6,10-dihydroxy-8-[(2s)-2-hydroxypropylidene]-4,4-dimethyl-5-oxatricyclo[4.4.0.0¹,³]decan-7-one

C14H20O5 (268.13106700000003)


   

4-methoxy-5-(3-methylbut-2-en-1-yl)-[1,1'-biphenyl]-3-ol

4-methoxy-5-(3-methylbut-2-en-1-yl)-[1,1'-biphenyl]-3-ol

C18H20O2 (268.146322)


   

1-(3-hydroxy-8,8-dimethyl-6,7-dihydro-5h-phenanthren-2-yl)ethanone

1-(3-hydroxy-8,8-dimethyl-6,7-dihydro-5h-phenanthren-2-yl)ethanone

C18H20O2 (268.146322)


   

(3e,5e)-trideca-3,5-dien-7,9,11-triyn-1-yl 3-methylbutanoate

(3e,5e)-trideca-3,5-dien-7,9,11-triyn-1-yl 3-methylbutanoate

C18H20O2 (268.146322)


   

(3s,6s,6's,7r)-6,7-dihydroxy-6,6'-dimethyl-4,7-dihydro-1h-spiro[cyclopenta[c]pyran-3,2'-oxan]-5-one

(3s,6s,6's,7r)-6,7-dihydroxy-6,6'-dimethyl-4,7-dihydro-1h-spiro[cyclopenta[c]pyran-3,2'-oxan]-5-one

C14H20O5 (268.13106700000003)


   

(8as)-8a-hydroxy-7-methoxy-3,3,6,8,8-pentamethyl-1,2-benzodioxin-5-one

(8as)-8a-hydroxy-7-methoxy-3,3,6,8,8-pentamethyl-1,2-benzodioxin-5-one

C14H20O5 (268.13106700000003)


   

3-[4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-4h,7h,8h-imidazo[4,5-d][1,3]diazepin-8-ol

3-[4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-4h,7h,8h-imidazo[4,5-d][1,3]diazepin-8-ol

C11H16N4O4 (268.1171496)


   

(4s,6s)-6-[(1s,2e,4e)-1,6-dihydroxyhexa-2,4-dien-1-yl]-3,4-dihydroxy-2,4-dimethylcyclohex-2-en-1-one

(4s,6s)-6-[(1s,2e,4e)-1,6-dihydroxyhexa-2,4-dien-1-yl]-3,4-dihydroxy-2,4-dimethylcyclohex-2-en-1-one

C14H20O5 (268.13106700000003)


   

9-chloro-10-hydroxypentadeca-6,12-dien-14-yn-4-one

9-chloro-10-hydroxypentadeca-6,12-dien-14-yn-4-one

C15H21ClO2 (268.1229996)


   

4-{2-[(2r,4r)-4-hydroxy-2-methyl-5-oxooxolan-2-yl]ethyl}-3-propyl-5h-furan-2-one

4-{2-[(2r,4r)-4-hydroxy-2-methyl-5-oxooxolan-2-yl]ethyl}-3-propyl-5h-furan-2-one

C14H20O5 (268.13106700000003)


   

butyl 4-{5-[(1r)-1-hydroxyethyl]furan-2-yl}-4-oxobutanoate

butyl 4-{5-[(1r)-1-hydroxyethyl]furan-2-yl}-4-oxobutanoate

C14H20O5 (268.13106700000003)


   

4-methoxy-1,5-dimethyl-2,6-dioxocyclohex-3-en-1-yl 2-methylbutanoate

4-methoxy-1,5-dimethyl-2,6-dioxocyclohex-3-en-1-yl 2-methylbutanoate

C14H20O5 (268.13106700000003)


   

6,7-dihydroxy-6,6'-dimethyl-4,7-dihydro-1h-spiro[cyclopenta[c]pyran-3,2'-oxan]-5-one

6,7-dihydroxy-6,6'-dimethyl-4,7-dihydro-1h-spiro[cyclopenta[c]pyran-3,2'-oxan]-5-one

C14H20O5 (268.13106700000003)


   

(3z,6r,9z,12s)-12-hydroxy-6,14-dimethyl-1,7-dioxacyclotetradeca-3,9-diene-2,8-dione

(3z,6r,9z,12s)-12-hydroxy-6,14-dimethyl-1,7-dioxacyclotetradeca-3,9-diene-2,8-dione

C14H20O5 (268.13106700000003)


   

5a,11a-dimethyl-6,12-dihydro-5,11-dioxa-6,12-diazatetracene

5a,11a-dimethyl-6,12-dihydro-5,11-dioxa-6,12-diazatetracene

C16H16N2O2 (268.12117159999997)


   

(2s,6's)-4-methyl-6'-(methylamino)-2'-azaspiro[furan-2,7'-tricyclo[6.3.1.0⁴,¹²]dodecane]-1'(11'),3',8'(12'),9'-tetraen-5-one

(2s,6's)-4-methyl-6'-(methylamino)-2'-azaspiro[furan-2,7'-tricyclo[6.3.1.0⁴,¹²]dodecane]-1'(11'),3',8'(12'),9'-tetraen-5-one

C16H16N2O2 (268.12117159999997)


   

1-(3,7-dihydroxy-8-methyl-9,10-dihydrophenanthren-4-yl)ethanone

1-(3,7-dihydroxy-8-methyl-9,10-dihydrophenanthren-4-yl)ethanone

C17H16O3 (268.10993859999996)


   

3-hydroxy-4,4-dimethyl-2-[(2z)-3-phenylprop-2-enoyl]cyclohexa-2,5-dien-1-one

3-hydroxy-4,4-dimethyl-2-[(2z)-3-phenylprop-2-enoyl]cyclohexa-2,5-dien-1-one

C17H16O3 (268.10993859999996)


   

5-(2-chloroethyl)-4-(hydroxymethyl)-2,2,6-trimethyl-1,3-dihydroinden-1-ol

5-(2-chloroethyl)-4-(hydroxymethyl)-2,2,6-trimethyl-1,3-dihydroinden-1-ol

C15H21ClO2 (268.1229996)


   

(2s,3r,4r,5r,6r)-2-methyl-6-(2-phenylethoxy)oxane-3,4,5-triol

(2s,3r,4r,5r,6r)-2-methyl-6-(2-phenylethoxy)oxane-3,4,5-triol

C14H20O5 (268.13106700000003)


   

6-hydroxy-4'-methoxy-3'-(prop-2-en-1-yl)-[1,1'-biphenyl]-3-carbaldehyde

6-hydroxy-4'-methoxy-3'-(prop-2-en-1-yl)-[1,1'-biphenyl]-3-carbaldehyde

C17H16O3 (268.10993859999996)


   

(3r)-2-{3-methoxy-2,6-dimethyl-7ah-furo[2,3-b]pyran-4-yl}butane-2,3-diol

(3r)-2-{3-methoxy-2,6-dimethyl-7ah-furo[2,3-b]pyran-4-yl}butane-2,3-diol

C14H20O5 (268.13106700000003)


   

8-chloro-2,2,5,8-tetramethyl-6-oxatricyclo[5.3.1.0¹,⁵]undec-3-ene-3-carbaldehyde

8-chloro-2,2,5,8-tetramethyl-6-oxatricyclo[5.3.1.0¹,⁵]undec-3-ene-3-carbaldehyde

C15H21ClO2 (268.1229996)


   

(3z,11z)-2,13-dihydroxy-7-methyl-6,15-dioxabicyclo[12.1.0]pentadeca-3,11-dien-5-one

(3z,11z)-2,13-dihydroxy-7-methyl-6,15-dioxabicyclo[12.1.0]pentadeca-3,11-dien-5-one

C14H20O5 (268.13106700000003)


   

[4-(1,2-dihydroxypropan-2-yl)-3-hydroxyphenyl]methyl 2-methylpropanoate

[4-(1,2-dihydroxypropan-2-yl)-3-hydroxyphenyl]methyl 2-methylpropanoate

C14H20O5 (268.13106700000003)


   

6,6-dimethyl-3-propylbenzo[c]chromen-1-ol

6,6-dimethyl-3-propylbenzo[c]chromen-1-ol

C18H20O2 (268.146322)


   

2-[(1e)-1-[(2e)-2-[1-(2-hydroxyphenyl)ethylidene]hydrazin-1-ylidene]ethyl]phenol

2-[(1e)-1-[(2e)-2-[1-(2-hydroxyphenyl)ethylidene]hydrazin-1-ylidene]ethyl]phenol

C16H16N2O2 (268.12117159999997)


   

(5r,6r,7r,8s)-8-ethyl-5,6,7-trihydroxy-2,3,8-trimethyl-6,7-dihydro-5h-chromen-4-one

(5r,6r,7r,8s)-8-ethyl-5,6,7-trihydroxy-2,3,8-trimethyl-6,7-dihydro-5h-chromen-4-one

C14H20O5 (268.13106700000003)


   

(8ar)-8a-hydroxy-3,3,6,6,8,8-hexamethyl-1,2-benzodioxine-5,7-dione

(8ar)-8a-hydroxy-3,3,6,6,8,8-hexamethyl-1,2-benzodioxine-5,7-dione

C14H20O5 (268.13106700000003)


   

8-ethyl-5,6,7-trihydroxy-2,3,8-trimethyl-6,7-dihydro-5h-chromen-4-one

8-ethyl-5,6,7-trihydroxy-2,3,8-trimethyl-6,7-dihydro-5h-chromen-4-one

C14H20O5 (268.13106700000003)


   

8-(4-hydroxyphenyl)-6,7-dimethyl-5,6,7,8-tetrahydronaphthalen-2-ol

8-(4-hydroxyphenyl)-6,7-dimethyl-5,6,7,8-tetrahydronaphthalen-2-ol

C18H20O2 (268.146322)


   

5,6-dihydroxy-6,6'-dimethyl-4,5-dihydro-1h-spiro[cyclopenta[c]pyran-3,2'-oxan]-7-one

5,6-dihydroxy-6,6'-dimethyl-4,5-dihydro-1h-spiro[cyclopenta[c]pyran-3,2'-oxan]-7-one

C14H20O5 (268.13106700000003)


   

7-hexyl-4-methoxy-4ah,7h,7ah-furo[3,4-b]pyran-2,5-dione

7-hexyl-4-methoxy-4ah,7h,7ah-furo[3,4-b]pyran-2,5-dione

C14H20O5 (268.13106700000003)


   

(2r)-5-hydroxy-7-methyl-2-(4-methylphenyl)-2,3-dihydro-1-benzopyran-4-one

(2r)-5-hydroxy-7-methyl-2-(4-methylphenyl)-2,3-dihydro-1-benzopyran-4-one

C17H16O3 (268.10993859999996)


   

(1s,2z,4s)-1-hydroxy-1-[(2s)-5-oxo-2h-furan-2-yl]oct-2-en-4-yl acetate

(1s,2z,4s)-1-hydroxy-1-[(2s)-5-oxo-2h-furan-2-yl]oct-2-en-4-yl acetate

C14H20O5 (268.13106700000003)


   

butyl 4-[5-(1-hydroxyethyl)furan-2-yl]-4-oxobutanoate

butyl 4-[5-(1-hydroxyethyl)furan-2-yl]-4-oxobutanoate

C14H20O5 (268.13106700000003)


   

(6z,9s,10r,12z)-9-chloro-10-hydroxypentadeca-6,12-dien-14-yn-4-one

(6z,9s,10r,12z)-9-chloro-10-hydroxypentadeca-6,12-dien-14-yn-4-one

C15H21ClO2 (268.1229996)


   

3-[(3s,5s)-3,5-dihydroxyhexanimidoyl]-5-(propan-2-ylidene)pyrrole-2,4-diol

3-[(3s,5s)-3,5-dihydroxyhexanimidoyl]-5-(propan-2-ylidene)pyrrole-2,4-diol

C13H20N2O4 (268.14230000000003)


   
   

(2s)-4-acetyl-2-[(5s)-5-hydroxyhex-1-en-1-yl]-5-methoxy-2-methylfuran-3-one

(2s)-4-acetyl-2-[(5s)-5-hydroxyhex-1-en-1-yl]-5-methoxy-2-methylfuran-3-one

C14H20O5 (268.13106700000003)


   

(2r,7r)-6-methyl-6,11-diazatetracyclo[7.6.1.0²,⁷.0¹²,¹⁶]hexadeca-1(16),3,9,12,14-pentaene-4-carboxylic acid

(2r,7r)-6-methyl-6,11-diazatetracyclo[7.6.1.0²,⁷.0¹²,¹⁶]hexadeca-1(16),3,9,12,14-pentaene-4-carboxylic acid

C16H16N2O2 (268.12117159999997)


   

3-(hydroxymethyl)-2,5-bis(3-methylbut-3-en-1-yn-1-yl)benzene-1,4-diol

3-(hydroxymethyl)-2,5-bis(3-methylbut-3-en-1-yn-1-yl)benzene-1,4-diol

C17H16O3 (268.10993859999996)


   

6,7-dihydroxy-6-methyl-2-(2-methylpropanoyl)-4,5,7,7a-tetrahydro-3ah-1-benzofuran-3-carbaldehyde

6,7-dihydroxy-6-methyl-2-(2-methylpropanoyl)-4,5,7,7a-tetrahydro-3ah-1-benzofuran-3-carbaldehyde

C14H20O5 (268.13106700000003)


   

6-(4-hydroxyphenyl)-2,2-dimethylchromen-8-ol

6-(4-hydroxyphenyl)-2,2-dimethylchromen-8-ol

C17H16O3 (268.10993859999996)


   

(1s)-5-(2-chloroethyl)-4-(hydroxymethyl)-2,2,6-trimethyl-1,3-dihydroinden-1-ol

(1s)-5-(2-chloroethyl)-4-(hydroxymethyl)-2,2,6-trimethyl-1,3-dihydroinden-1-ol

C15H21ClO2 (268.1229996)


   

2,7-dihydroxy-3,8-dimethyl-9,10-dihydrophenanthrene-4-carbaldehyde

2,7-dihydroxy-3,8-dimethyl-9,10-dihydrophenanthrene-4-carbaldehyde

C17H16O3 (268.10993859999996)


   

[(1s,4as,7s,7ar)-1-(acetyloxy)-7-methyl-1h,4ah,5h,6h,7h,7ah-cyclopenta[c]pyran-4-yl]methyl acetate

[(1s,4as,7s,7ar)-1-(acetyloxy)-7-methyl-1h,4ah,5h,6h,7h,7ah-cyclopenta[c]pyran-4-yl]methyl acetate

C14H20O5 (268.13106700000003)


   

(1r)-4-methoxy-1,5-dimethyl-2,6-dioxocyclohex-3-en-1-yl 2-methylbutanoate

(1r)-4-methoxy-1,5-dimethyl-2,6-dioxocyclohex-3-en-1-yl 2-methylbutanoate

C14H20O5 (268.13106700000003)


   

(3z,6r,9z,11r,13r)-11-(hydroxymethyl)-6,13-dimethyl-1,7-dioxacyclotrideca-3,9-diene-2,8-dione

(3z,6r,9z,11r,13r)-11-(hydroxymethyl)-6,13-dimethyl-1,7-dioxacyclotrideca-3,9-diene-2,8-dione

C14H20O5 (268.13106700000003)


   

(3r,4's)-4',6-dimethylspiro[naphtho[1,2-c]furan-3,2'-oxolan]-1-one

(3r,4's)-4',6-dimethylspiro[naphtho[1,2-c]furan-3,2'-oxolan]-1-one

C17H16O3 (268.10993859999996)


   

(3s,4's)-4',6-dimethylspiro[naphtho[1,2-c]furan-3,2'-oxolan]-1-one

(3s,4's)-4',6-dimethylspiro[naphtho[1,2-c]furan-3,2'-oxolan]-1-one

C17H16O3 (268.10993859999996)


   

4,6,9-trimethyl-8-methylidenepyrido[3,2-g]quinoline-2,10-diol

4,6,9-trimethyl-8-methylidenepyrido[3,2-g]quinoline-2,10-diol

C16H16N2O2 (268.12117159999997)


   

(1r)-4-methoxy-1,3-dimethyl-2,6-dioxocyclohex-3-en-1-yl (2r)-2-methylbutanoate

(1r)-4-methoxy-1,3-dimethyl-2,6-dioxocyclohex-3-en-1-yl (2r)-2-methylbutanoate

C14H20O5 (268.13106700000003)


   

1-hydroxy-1-(5-oxo-2h-furan-2-yl)oct-2-en-4-yl acetate

1-hydroxy-1-(5-oxo-2h-furan-2-yl)oct-2-en-4-yl acetate

C14H20O5 (268.13106700000003)


   

(6r,7s,8s)-8-(4-hydroxyphenyl)-6,7-dimethyl-5,6,7,8-tetrahydronaphthalen-2-ol

(6r,7s,8s)-8-(4-hydroxyphenyl)-6,7-dimethyl-5,6,7,8-tetrahydronaphthalen-2-ol

C18H20O2 (268.146322)


   

5-methoxy-4-(3-methylbut-2-en-1-yl)-[1,1'-biphenyl]-3-ol

5-methoxy-4-(3-methylbut-2-en-1-yl)-[1,1'-biphenyl]-3-ol

C18H20O2 (268.146322)


   

6-(1,6-dihydroxyhexa-2,4-dien-1-yl)-3,4-dihydroxy-2,4-dimethylcyclohex-2-en-1-one

6-(1,6-dihydroxyhexa-2,4-dien-1-yl)-3,4-dihydroxy-2,4-dimethylcyclohex-2-en-1-one

C14H20O5 (268.13106700000003)


   

3-(3,5-dihydroxyhexanimidoyl)-5-(propan-2-ylidene)pyrrole-2,4-diol

3-(3,5-dihydroxyhexanimidoyl)-5-(propan-2-ylidene)pyrrole-2,4-diol

C13H20N2O4 (268.14230000000003)


   

(3s,6s,6's,7s)-6,7-dihydroxy-6,6'-dimethyl-4,7-dihydro-1h-spiro[cyclopenta[c]pyran-3,2'-oxan]-5-one

(3s,6s,6's,7s)-6,7-dihydroxy-6,6'-dimethyl-4,7-dihydro-1h-spiro[cyclopenta[c]pyran-3,2'-oxan]-5-one

C14H20O5 (268.13106700000003)


   

(8s)-14-hydroxy-7,7,13-trimethyltricyclo[9.4.0.0³,⁸]pentadeca-1(11),2,4,12,14-pentaen-6-one

(8s)-14-hydroxy-7,7,13-trimethyltricyclo[9.4.0.0³,⁸]pentadeca-1(11),2,4,12,14-pentaen-6-one

C18H20O2 (268.146322)


   

(2r)-2,3-dihydroxy-2-(2-hydroxy-4-methylphenyl)propyl 2-methylpropanoate

(2r)-2,3-dihydroxy-2-(2-hydroxy-4-methylphenyl)propyl 2-methylpropanoate

C14H20O5 (268.13106700000003)


   

(1r)-4-methoxy-1,3-dimethyl-2,6-dioxocyclohex-3-en-1-yl 2-methylbutanoate

(1r)-4-methoxy-1,3-dimethyl-2,6-dioxocyclohex-3-en-1-yl 2-methylbutanoate

C14H20O5 (268.13106700000003)


   

(8as)-8a-hydroxy-3,3,6,6,8,8-hexamethyl-1,2-benzodioxine-5,7-dione

(8as)-8a-hydroxy-3,3,6,6,8,8-hexamethyl-1,2-benzodioxine-5,7-dione

C14H20O5 (268.13106700000003)


   

5,5'-dihydroxy-4,4',8,8-tetramethyl-7-oxaspiro[bicyclo[3.2.1]octane-6,2'-oxolan]-3-en-2-one

5,5'-dihydroxy-4,4',8,8-tetramethyl-7-oxaspiro[bicyclo[3.2.1]octane-6,2'-oxolan]-3-en-2-one

C14H20O5 (268.13106700000003)


   

n-[(3s,9z)-8-hydroxy-10-methyl-2-oxo-1-oxa-7-azacyclododeca-7,9-dien-3-yl]ethanimidic acid

n-[(3s,9z)-8-hydroxy-10-methyl-2-oxo-1-oxa-7-azacyclododeca-7,9-dien-3-yl]ethanimidic acid

C13H20N2O4 (268.14230000000003)


   

14-hydroxy-7,7,13-trimethyltricyclo[9.4.0.0³,⁸]pentadeca-1(11),2,4,12,14-pentaen-6-one

14-hydroxy-7,7,13-trimethyltricyclo[9.4.0.0³,⁸]pentadeca-1(11),2,4,12,14-pentaen-6-one

C18H20O2 (268.146322)


   

5-methoxy-6-methyl-2-phenyl-4h-chromen-7-ol

5-methoxy-6-methyl-2-phenyl-4h-chromen-7-ol

C17H16O3 (268.10993859999996)


   

2,3-dihydroxy-2-(2-hydroxy-4-methylphenyl)propyl 2-methylpropanoate

2,3-dihydroxy-2-(2-hydroxy-4-methylphenyl)propyl 2-methylpropanoate

C14H20O5 (268.13106700000003)


   

6,10-dihydroxy-8-(2-hydroxypropylidene)-4,4-dimethyl-5-oxatricyclo[4.4.0.0¹,³]decan-7-one

6,10-dihydroxy-8-(2-hydroxypropylidene)-4,4-dimethyl-5-oxatricyclo[4.4.0.0¹,³]decan-7-one

C14H20O5 (268.13106700000003)


   

4-[(1e,3s)-4-(4-hydroxyphenyl)-2,3-dimethylbut-1-en-1-yl]phenol

4-[(1e,3s)-4-(4-hydroxyphenyl)-2,3-dimethylbut-1-en-1-yl]phenol

C18H20O2 (268.146322)


   

(1r,5s,7r,8s)-8-chloro-2,2,5,8-tetramethyl-6-oxatricyclo[5.3.1.0¹,⁵]undec-3-ene-3-carbaldehyde

(1r,5s,7r,8s)-8-chloro-2,2,5,8-tetramethyl-6-oxatricyclo[5.3.1.0¹,⁵]undec-3-ene-3-carbaldehyde

C15H21ClO2 (268.1229996)


   

(1s,3r,6s,8e,10s)-6,10-dihydroxy-8-[(2r)-2-hydroxypropylidene]-4,4-dimethyl-5-oxatricyclo[4.4.0.0¹,³]decan-7-one

(1s,3r,6s,8e,10s)-6,10-dihydroxy-8-[(2r)-2-hydroxypropylidene]-4,4-dimethyl-5-oxatricyclo[4.4.0.0¹,³]decan-7-one

C14H20O5 (268.13106700000003)


   

methyl 2-hydroxy-3-[(2r,3e,4s,5s)-4-hydroxy-2,5-bis[(1e)-prop-1-en-1-yl]oxolan-3-ylidene]propanoate

methyl 2-hydroxy-3-[(2r,3e,4s,5s)-4-hydroxy-2,5-bis[(1e)-prop-1-en-1-yl]oxolan-3-ylidene]propanoate

C14H20O5 (268.13106700000003)


   
   

2-phenylethyl (2e)-3-(4-hydroxyphenyl)prop-2-enoate

2-phenylethyl (2e)-3-(4-hydroxyphenyl)prop-2-enoate

C17H16O3 (268.10993859999996)


   

4-methyl-9-(3-methylbut-2-en-1-yl)furo[3,2-g]chromen-7-one

4-methyl-9-(3-methylbut-2-en-1-yl)furo[3,2-g]chromen-7-one

C17H16O3 (268.10993859999996)


   

(1s,4'r)-4',7-dimethylspiro[naphtho[1,2-c]furan-1,2'-oxolan]-3-one

(1s,4'r)-4',7-dimethylspiro[naphtho[1,2-c]furan-1,2'-oxolan]-3-one

C17H16O3 (268.10993859999996)


   

(8r)-14-hydroxy-7,7,13-trimethyltricyclo[9.4.0.0³,⁸]pentadeca-1(11),2,4,12,14-pentaen-6-one

(8r)-14-hydroxy-7,7,13-trimethyltricyclo[9.4.0.0³,⁸]pentadeca-1(11),2,4,12,14-pentaen-6-one

C18H20O2 (268.146322)


   

2-benzoyl-6-methoxy-4-(prop-2-en-1-yl)phenol

2-benzoyl-6-methoxy-4-(prop-2-en-1-yl)phenol

C17H16O3 (268.10993859999996)


   

(3z,6r,10e,13r)-11-(hydroxymethyl)-6,13-dimethyl-1,7-dioxacyclotrideca-3,10-diene-2,8-dione

(3z,6r,10e,13r)-11-(hydroxymethyl)-6,13-dimethyl-1,7-dioxacyclotrideca-3,10-diene-2,8-dione

C14H20O5 (268.13106700000003)


   

6,8-dihydroxy-3-(4-oxopentyl)-3,4,4a,5,6,7-hexahydro-2-benzopyran-1-one

6,8-dihydroxy-3-(4-oxopentyl)-3,4,4a,5,6,7-hexahydro-2-benzopyran-1-one

C14H20O5 (268.13106700000003)


   

7-(4-hydroxyphenyl)-2,2-dimethylchromen-5-ol

7-(4-hydroxyphenyl)-2,2-dimethylchromen-5-ol

C17H16O3 (268.10993859999996)


   

(1z,3s)-1-[(2s,3s)-3-hydroxy-6-oxo-2,3-dihydropyran-2-yl]hept-1-en-3-yl acetate

(1z,3s)-1-[(2s,3s)-3-hydroxy-6-oxo-2,3-dihydropyran-2-yl]hept-1-en-3-yl acetate

C14H20O5 (268.13106700000003)


   

4',7-dimethylspiro[naphtho[1,2-c]furan-1,2'-oxolan]-3-one

4',7-dimethylspiro[naphtho[1,2-c]furan-1,2'-oxolan]-3-one

C17H16O3 (268.10993859999996)


   

2-methoxy-6,6-dimethylbenzo[c]chromene-9-carbaldehyde

2-methoxy-6,6-dimethylbenzo[c]chromene-9-carbaldehyde

C17H16O3 (268.10993859999996)


   

(3s)-1,3-bis(4-hydroxyphenyl)pent-4-en-1-one

(3s)-1,3-bis(4-hydroxyphenyl)pent-4-en-1-one

C17H16O3 (268.10993859999996)


   

(3as,6r,7s,7ar)-6,7-dihydroxy-6-methyl-2-(2-methylpropanoyl)-4,5,7,7a-tetrahydro-3ah-1-benzofuran-3-carbaldehyde

(3as,6r,7s,7ar)-6,7-dihydroxy-6-methyl-2-(2-methylpropanoyl)-4,5,7,7a-tetrahydro-3ah-1-benzofuran-3-carbaldehyde

C14H20O5 (268.13106700000003)


   

(3s,4'r)-4',6-dimethylspiro[naphtho[1,2-c]furan-3,2'-oxolan]-1-one

(3s,4'r)-4',6-dimethylspiro[naphtho[1,2-c]furan-3,2'-oxolan]-1-one

C17H16O3 (268.10993859999996)


   

2-{3-methoxy-2,6-dimethyl-7ah-furo[2,3-b]pyran-4-yl}butane-2,3-diol

2-{3-methoxy-2,6-dimethyl-7ah-furo[2,3-b]pyran-4-yl}butane-2,3-diol

C14H20O5 (268.13106700000003)


   

(1r,5r)-4-methoxy-1,5-dimethyl-2,6-dioxocyclohex-3-en-1-yl (2r)-2-methylbutanoate

(1r,5r)-4-methoxy-1,5-dimethyl-2,6-dioxocyclohex-3-en-1-yl (2r)-2-methylbutanoate

C14H20O5 (268.13106700000003)


   

(7s)-7-hexyl-4-methoxy-4ah,7h,7ah-furo[3,4-b]pyran-2,5-dione

(7s)-7-hexyl-4-methoxy-4ah,7h,7ah-furo[3,4-b]pyran-2,5-dione

C14H20O5 (268.13106700000003)


   

(2s,6'r)-4-methyl-6'-(methylamino)-2'-azaspiro[furan-2,7'-tricyclo[6.3.1.0⁴,¹²]dodecane]-1'(11'),3',8'(12'),9'-tetraen-5-one

(2s,6'r)-4-methyl-6'-(methylamino)-2'-azaspiro[furan-2,7'-tricyclo[6.3.1.0⁴,¹²]dodecane]-1'(11'),3',8'(12'),9'-tetraen-5-one

C16H16N2O2 (268.12117159999997)


   

trideca-3,5-dien-7,9,11-triyn-1-yl 3-methylbutanoate

trideca-3,5-dien-7,9,11-triyn-1-yl 3-methylbutanoate

C18H20O2 (268.146322)