Exact Mass: 298.11175019999996

Exact Mass Matches: 298.11175019999996

Found 500 metabolites which its exact mass value is equals to given mass value 298.11175019999996, within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error 0.01 dalton.

7-Methylguanosine

7-Methylguanosine

[C11H16N5O5]+ (298.1151386)


CONFIDENCE standard compound; INTERNAL_ID 316

   

Picein

1-(4-(((2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)phenyl)ethanone

C14H18O7 (298.10524780000003)


Picein is a glycoside. Picein is a natural product found in Salix candida, Halocarpus biformis, and other organisms with data available. Picein, isolated from Picrorhiza kurroa, is a naturally occurring antioxidant[1]. Picein, isolated from Picrorhiza kurroa, is a naturally occurring antioxidant[1].

   

Enterolactone

()-trans-dihydro-3R,4R-bis[(3-hydroxyphenyl)methyl]-2(3H)-furanone

C18H18O4 (298.1205028)


Enterolactone (CAS: 78473-71-9) is a mammalian lignan that has a similar biphenolic structure to lignans from plants. Lignans are compounds with estrogenic properties and are probably the most important source of phytoestrogens in western diets. Mammalian lignans are formed from precursors that are contained mainly in vegetables, whole grain products, and berries, via the action of intestinal microflora. Enterolactone is produced in the colon by the action of bacteria on secoisolariciresinol, matairesinol, and its glycosides. Secoisolariciresinol is converted to enterodiol which is subsequently converted to enterolactone as it passes through the colon. Matairesinol is converted directly to enterolactone. Enterolactone has been shown to possess weakly estrogenic and antiestrogenic activities, and it has been suggested that the high production of this antiestrogenic mammalian lignans in the gut may serve to protect against breast cancer in women and prostate cancer in men; however epidemiological evidence to date is conflicting (PMID: 16168401, 12270221, 11216511, 12107024). Enterolactone is a biomarker for the consumption of soybeans and other soy products. D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones > D004967 - Estrogens

   

Thalassemine

Thalassemine; L-Thalassemine

C8H19N4O6P (298.1042164)


   

Dibenzylsuccinate

DIBENZYL SUCCINATE

C18H18O4 (298.1205028)


   

Spirolaurenone

1-[(2R,5S,9R)-9-Bromo-6,10,10-trimethylspiro[4.5]dec-6-en-2-yl]ethan-1-one

C15H23BrO (298.0932168)


A spirocyclic sesquiterpenoid that is isolated from the red alga Laurencia glandulifera.

   

Antibiotic PS 5

3-(2-Acetamidoethyl)thio-6-ethyl-7-oxo-1-azabicyclo(3.2.0)hept-2-ene-2-carboxylic acid

C13H18N2O4S (298.0987228)


D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D013845 - Thienamycins D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D047090 - beta-Lactams D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D007769 - Lactams

   

Astra 1397

10-(beta-Dimethylaminopropionyl)phenothiazine

C17H18N2OS (298.11397780000004)


A - Alimentary tract and metabolism > A03 - Drugs for functional gastrointestinal disorders > A03A - Drugs for functional gastrointestinal disorders > A03AC - Synthetic antispasmodics, amides with tertiary amines

   

7-Methylguanosine

2-amino-9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-7-methyl-6-oxo-6,7-dihydro-3H-9lambda5-purin-9-ylium

C11H16N5O5+ (298.1151386)


7-methylguanosine is an endogenous methylated nucleoside found in human fluids; methylated purine bases are present in higher amounts in tumor-bearing patients compared to healthy controls.DNA hypermethylation is a common finding in malignant cells and has been explored as a therapeutic target for hypomethylating agents. When chemical bonds to DNA, the DNA becomes damaged and proper and complete replication cannot occur to make the normal intended cell. A DNA adduct is an abnormal piece of DNA covalently-bonded to a cancer-causing chemical. This has shown to be the start of a cancerous cell, or carcinogenesis. DNA adducts in scientific experiments are used as bio-markers and as such are themselves measured to reflect quantitatively, for comparison, the amount of cancer in the subject. 7-Methylguanosine is a substrate for purine-nucleoside phosphorylase and Eukaryotic translation initiation factor 4E. (PMID: 3506820, 17044778, 17264127, 16799933) [HMDB] 7-methylguanosine is an endogenous methylated nucleoside found in human fluids; methylated purine bases are present in higher amounts in tumor-bearing patients compared to healthy controls.DNA hypermethylation is a common finding in malignant cells and has been explored as a therapeutic target for hypomethylating agents. When chemical bonds to DNA, the DNA becomes damaged and proper and complete replication cannot occur to make the normal intended cell. A DNA adduct is an abnormal piece of DNA covalently-bonded to a cancer-causing chemical. This has shown to be the start of a cancerous cell, or carcinogenesis. DNA adducts in scientific experiments are used as bio-markers and as such are themselves measured to reflect quantitatively, for comparison, the amount of cancer in the subject. 7-Methylguanosine is a substrate for purine-nucleoside phosphorylase and Eukaryotic translation initiation factor 4E. (PMID:3506820, 17044778, 17264127, 16799933).

   

Amlexanox

2-Amino-7-isopropyl-5-oxo-5H-(1)benzopyrano(2,3-b)pyridine-3-carboxylic acid

C16H14N2O4 (298.0953524)


Amlexanox is an antiallergic drug, clinically effective for atopic diseases, especially allergic asthma and rhinitis. Amlexanox as a topical paste is a well tolerated treatment of recurrent aphthous ulcers. Recurrent aphthous ulcer (RAU) is the most prevalent oral mucosal disease in humans, estimated to affect between 5\\% and 50\\% of the general population. A - Alimentary tract and metabolism > A01 - Stomatological preparations > A01A - Stomatological preparations C308 - Immunotherapeutic Agent > C29578 - Histamine-1 Receptor Antagonist R - Respiratory system > R03 - Drugs for obstructive airway diseases D018926 - Anti-Allergic Agents

   

(+)-Ligballinol

4-[4-(4-hydroxyphenyl)-hexahydrofuro[3,4-c]furan-1-yl]phenol

C18H18O4 (298.1205028)


(+)-ligballinol is a member of the class of compounds known as furanoid lignans. Furanoid lignans are lignans with a structure that contains either a tetrahydrofuran ring, a furan ring, or a furofuan ring system, that arises from the joining of the two phenylpropanoid units (+)-ligballinol is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). (+)-ligballinol can be found in pulses, which makes (+)-ligballinol a potential biomarker for the consumption of this food product. (+)-Ligballinol is found in pulses. (+)-Ligballinol is a stress metabolite of cell cultures of Vigna angularis (azuki bean

   

1-(2,4-Dihydroxy-6-methoxy-3,5-dimethylphenyl)-3-phenyl-2-propen-1-one

(2E)-1-(2,4-dihydroxy-6-methoxy-3,5-dimethylphenyl)-3-phenylprop-2-en-1-one

C18H18O4 (298.1205028)


1-(2,4-Dihydroxy-6-methoxy-3,5-dimethylphenyl)-3-phenyl-2-propen-1-one is found in herbs and spices. 1-(2,4-Dihydroxy-6-methoxy-3,5-dimethylphenyl)-3-phenyl-2-propen-1-one is isolated from Myrica gale (bog myrtle). Isolated from Myrica gale (bog myrtle). 1-(2,4-Dihydroxy-6-methoxy-3,5-dimethylphenyl)-3-phenyl-2-propen-1-one is found in herbs and spices.

   

7-Hydroxy-5-methoxy-6,8-dimethylflavanone

7-hydroxy-5-methoxy-6,8-dimethyl-2-phenyl-3,4-dihydro-2H-1-benzopyran-4-one

C18H18O4 (298.1205028)


7-Hydroxy-5-methoxy-6,8-dimethylflavanone is found in fruits. 7-Hydroxy-5-methoxy-6,8-dimethylflavanone is a constituent of Eugenia javanica (Java apple)

   

8-Deoxy-11-hydroxy-13-chlorogrosheimin

3-(chloromethyl)-3-hydroxy-9-methyl-6-methylidene-dodecahydroazuleno[4,5-b]furan-2,8-dione

C15H19ClO4 (298.0971804)


8-Deoxy-11-hydroxy-13-chlorogrosheimin is found in green vegetables. 8-Deoxy-11-hydroxy-13-chlorogrosheimin is a constituent of Cynara scolymus (artichoke). Constituent of Cynara scolymus (artichoke). 8-Deoxy-11-hydroxy-13-chlorogrosheimin is found in green vegetables.

   

5,7-Dimethoxy-6-methylflavanone

5,7-dimethoxy-6-methyl-2-phenyl-3,4-dihydro-2H-1-benzopyran-4-one

C18H18O4 (298.1205028)


5,7-Dimethoxy-6-methylflavanone is found in tea. 5,7-Dimethoxy-6-methylflavanone is a constituent of Leptospermum scoparium (red tea). Constituent of Leptospermum scoparium (red tea). 5,7-Dimethoxy-6-methylflavanone is found in tea.

   

7C-aglycone

(4Z)-4-methyl-6-(3-methyl-1,4-dioxo-1,4-dihydronaphthalen-2-yl)hex-4-enoic acid

C18H18O4 (298.1205028)


7C-aglycone is one of the two major aglycone urinary water-soluble metabolites of Phylloquinone (Vitamin K1) and menaquinones (vitamin K2), usually excreted as glucuronide conjugates; their structure suggests that they are formed by an oxidative degradation of the phytyl side chain involving enzymes of omega- and beta-oxidation. Newborn infants as a group, are known to have precariously low vitamin K stores and are routinely given vitamin K prophylaxis at birth. (PMIDs 7306367, 4833371, 15722567) [HMDB] 7C-aglycone is one of the two major aglycone urinary water-soluble metabolites of Phylloquinone (Vitamin K1) and menaquinones (vitamin K2), usually excreted as glucuronide conjugates; their structure suggests that they are formed by an oxidative degradation of the phytyl side chain involving enzymes of omega- and beta-oxidation. Newborn infants as a group, are known to have precariously low vitamin K stores and are routinely given vitamin K prophylaxis at birth. (PMIDs 7306367, 4833371, 15722567).

   

2-Phenylethanol glucuronide

(2S,3S,4S,5R,6R)-3,4,5-trihydroxy-6-(2-phenylethoxy)oxane-2-carboxylic acid

C14H18O7 (298.10524780000003)


2-Phenylethanol glucuronide is a natural human metabolite of 2-phenylethanol generated in the liver by UDP glucuonyltransferase. Glucuronidation is used to assist in the excretion of toxic substances, drugs or other substances that cannot be used as an energy source. Glucuronic acid is attached via a glycosidic bond to the substance, and the resulting glucuronide, which has a much higher water solubility than the original substance, is eventually excreted by the kidneys. [HMDB] 2-Phenylethanol glucuronide is a natural human metabolite of 2-phenylethanol generated in the liver by UDP glucuonyltransferase. Glucuronidation is used to assist in the excretion of toxic substances, drugs or other substances that cannot be used as an energy source. Glucuronic acid is attached via a glycosidic bond to the substance, and the resulting glucuronide, which has a much higher water solubility than the original substance, is eventually excreted by the kidneys.

   

N-Desmethyl Olanzapine

5-methyl-8-(piperazin-1-yl)-4-thia-2,9-diazatricyclo[8.4.0.0³,⁷]tetradeca-1(14),3(7),5,8,10,12-hexaene

C16H18N4S (298.12521080000005)


4-N-desmethylolanzapine is a metabolite of olanzapine. Olanzapine (trade name Zyprexa or in combination with fluoxetine Symbyax) is an atypical antipsychotic, approved by the FDA for the treatment of schizophrenia and bipolar disorder. Olanzapine is structurally similar to clozapine, but is classified as a thienobenzodiazepine. The olanzapine formulations are manufactured and marketed by the pharmaceutical company Eli Lilly and Company; the drug went generic in 2011. Sales of Zyprexa in 2008 were $2.2B in the US alone, and $4.7B in total. (Wikipedia)

   

LysoPA(8:0/0:0)

[2-hydroxy-3-(octanoyloxy)propoxy]phosphonic acid

C11H23O7P (298.1181338)


LysoPA(8:0/0:0) is a lysophosphatidic acid. It is a glycerophospholipid in which a phosphate moiety occupies a glycerol substitution site. Lysophosphatidic acids can have different combinations of fatty acids of varying lengths and saturation attached at the C-1 (sn-1) or C-2 (sn-2) position. Fatty acids containing 16 and 18 carbons are the most common. LysoPA(8:0/0:0), in particular, consists of one chain of caprylic acid at the C-1 position. Lysophosphatidic acid is the simplest possible glycerophospholipid. It is the biosynthetic precursor of phosphatidic acid. Although it is present at very low levels only in animal tissues, it is extremely important biologically, influencing many biochemical processes.

   

4-Ethylphenol glucuronide

(2S,3S,4S,5R,6S)-6-(4-ethylphenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid

C14H18O7 (298.10524780000003)


4-Ethylphenol glucuronide belongs to the class of organic compounds known as phenolic glycosides. These are organic compounds containing a phenolic structure attached to a glycosyl moiety. Some examples of phenolic structures include lignans and flavonoids. Among the sugar units found in natural glycosides are D-glucose, L-fructose, and L rhamnose. 4-Ethylphenol glucuronide is a uremic toxin (PMID: 30087103).

   

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

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

C18H18O4 (298.1205028)


   

2-[6-(4-Chlorophenoxy)hexyl]oxirane-2-carboxylic acid

2-[6-(4-Chlorophenoxy)hexyl]oxirane-2-carboxylic acid

C15H19ClO4 (298.0971804)


   

1H-Pyrrole-2,5-dione, 1-[7-(dimethylamino)-4-methyl-2-oxo-2H-1-benzopyran-3-yl]-

1-[7-(dimethylamino)-4-methyl-2-oxo-2H-chromen-3-yl]-2,5-dihydro-1H-pyrrole-2,5-dione

C16H14N2O4 (298.0953524)


D019995 - Laboratory Chemicals > D007202 - Indicators and Reagents > D049408 - Luminescent Agents D004396 - Coloring Agents > D005456 - Fluorescent Dyes

   

8-Aminoguanosine

2,8-diamino-9-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-6,9-dihydro-1H-purin-6-one

C10H14N6O5 (298.1025634)


   

Bilin

5-[(2H-pyrrol-2-ylidene)methyl]-2-({5-[(2H-pyrrol-2-ylidene)methyl]-1H-pyrrol-2-yl}methylidene)-2H-pyrrole

C19H14N4 (298.1218404)


   

Corrole

20,21,22,23-tetraazapentacyclo[15.2.1.1^{2,5}.1^{7,10}.1^{12,15}]tricosa-1(20),2,4,6,8,10,12,14,16,18-decaene

C19H14N4 (298.1218404)


   

2,3,4,5-Tetrahydroxy-6-(1,2,3,4-tetrahydroxybutyl)oxane-2-carbaldehyde

2,3,4,5-Tetrahydroxy-6-(1,2,3,4-tetrahydroxybutyl)oxane-2-carbaldehyde

C10H18O10 (298.0899928)


   

Pentaerythritol triacrylate

3-Hydroxy-2,2-bis[(prop-2-enoyloxy)methyl]propyl prop-2-enoic acid

C14H18O7 (298.10524780000003)


   

(5R,6R)-3-(2-Acetamidoethylsulfanyl)-6-ethyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid

6-Ethyl-3-({2-[(1-hydroxyethylidene)amino]ethyl}sulphanyl)-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid

C13H18N2O4S (298.0987228)


   

Chakanoside I

1-phenyl-2-{[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}ethan-1-one

C14H18O7 (298.10524780000003)


Chakanoside i is a member of the class of compounds known as alkyl-phenylketones. Alkyl-phenylketones are aromatic compounds containing a ketone substituted by one alkyl group, and a phenyl group. Chakanoside i is soluble (in water) and a very weakly acidic compound (based on its pKa). Chakanoside i can be found in tea, which makes chakanoside i a potential biomarker for the consumption of this food product.

   

Infectocaryone

[ (1R) -5-Oxo-6- (1-hydroxy-3-phenyl-2-propenylidene) -3-cyclohexenyl ] acetic acid methyl ester

C18H18O4 (298.1205028)


   
   

[3R-(3alph,3aalpha,7alpha,7aalpha)]-7-Dimethyl-3,7a-bis(acetyloxy)hexahydro-3a 1,4-isobenzofurandione

[3R-(3alph,3aalpha,7alpha,7aalpha)]-7-Dimethyl-3,7a-bis(acetyloxy)hexahydro-3a 1,4-isobenzofurandione

C14H18O7 (298.10524780000003)


   
   
   
   
   

Ligballinol

p-coumarylresinol

C18H18O4 (298.1205028)


   

13-Chlorosolstitialin

13-Chlorosolstitialin

C15H19ClO4 (298.0971804)


   
   
   

7,4-Dimethoxy-6-C-methylflavanone

7,4-Dimethoxy-6-C-methylflavanone

C18H18O4 (298.1205028)


   
   
   

2-Phenylethyl Ferulate

2-Phenylethyl Ferulate

C18H18O4 (298.1205028)


   
   

10-Bromo-2,3-epoxy-7-chamigrene

10-Bromo-2,3-epoxy-7-chamigrene

C15H23BrO (298.0932168)


   

Capillarin isovalerate

Capillarin isovalerate

C18H18O4 (298.1205028)


   
   
   
   
   

[3R-(3alph,3aalpha,7beta,7aalpha)]-7-Dimethyl-3,7a-bis(acetyloxy)hexahydro-3a 1,4-isobenzofurandione

[3R-(3alph,3aalpha,7beta,7aalpha)]-7-Dimethyl-3,7a-bis(acetyloxy)hexahydro-3a 1,4-isobenzofurandione

C14H18O7 (298.10524780000003)


   

[3S-(3alpha,3abeta,7beta,7abeta)]-7-Dimethyl-3,7a-bis(acetyloxy)hexahydro-3a 1,4-isobenzofurandione

[3S-(3alpha,3abeta,7beta,7abeta)]-7-Dimethyl-3,7a-bis(acetyloxy)hexahydro-3a 1,4-isobenzofurandione

C14H18O7 (298.10524780000003)


   

[3S-(3alpha,3abeta,7alpha,7abeta)]-7-dimethyl-3,7a-bis(acetyloxy)hexahydro-3a 1,4-Isobenzofurandione

[3S-(3alpha,3abeta,7alpha,7abeta)]-7-dimethyl-3,7a-bis(acetyloxy)hexahydro-3a 1,4-Isobenzofurandione

C14H18O7 (298.10524780000003)


   
   

4,6-Dihydroxy-3,5-dimethyl-2-methoxychalcone

4,6-Dihydroxy-3,5-dimethyl-2-methoxychalcone

C18H18O4 (298.1205028)


   

Hofmeisterin II

1,4-Bis(2-hydroxy-4-methylphenyl)butane-1,4-dione

C18H18O4 (298.1205028)


A natural product found in Eupatorium cannabinum subspecies asiaticum.

   

5-Hydroxy-7-methoxy-6,8-di-C-methylflavanone

5-Hydroxy-7-methoxy-6,8-di-C-methylflavanone

C18H18O4 (298.1205028)


   

STEMOFURAN J

STEMOFURAN J

C18H18O4 (298.1205028)


A natural product found in Stemona curtisii and Stemona aphylla.

   

STEMOFURAN F

STEMOFURAN F

C18H18O4 (298.1205028)


A natural product found in Stemona curtisii and Stemona aphylla.

   

aurentiacin

2-Hydroxy-4,6-methoxy-3-methylchalcone

C18H18O4 (298.1205028)


   

2,4-Dihydroxy-6-methoxy-3,5-dimethylchalcone

2,4-Dihydroxy-6-methoxy-3,5-dimethylchalcone

C18H18O4 (298.1205028)


A member of the class of chalcones that is trans-chalcone substituted by hydroxy groups at positions 2 and 4, a methoxy group at position 6 and methyl groups at positions 3 and 5. Isolated from the buds of Cleistocalyx operculatus, it has been shown to exhibit inhibitory effects on the viral neuraminidases from two influenza viral strains, H1N1 and H9N2.

   
   

2-(1-Methyl-1H-pyrrol-2-yl)-3-(3,4,5-trimethoxyphenyl)acrylonitrile

2-(1-Methyl-1H-pyrrol-2-yl)-3-(3,4,5-trimethoxyphenyl)acrylonitrile

C17H18N2O3 (298.1317358)


   

(5-amino-3-triazolo[1,5-a]quinazolinyl)-(4-morpholinyl)methanone

(5-amino-3-triazolo[1,5-a]quinazolinyl)-(4-morpholinyl)methanone

C14H14N6O2 (298.1178184)


   
   
   
   
   
   
   

3-phenyl-1-(2,4,6-trimethoxyphenyl)prop-2-en-1-one

3-phenyl-1-(2,4,6-trimethoxyphenyl)prop-2-en-1-one

C18H18O4 (298.1205028)


   

Acetoxydehydrocacalohastine

Acetoxydehydrocacalohastine

C18H18O4 (298.1205028)


   

1-(2,4-dihydroxy-6-[(1E)-2-(4-hydroxyphenyl)ethenyl]-phenyl)-2-methyl-1-propanone|1-{2,4-dihydroxy-6-[(1E)-2-(4-hydroxyphenyl)ethenyl]phenyl}-2-methyl-1-propanone

1-(2,4-dihydroxy-6-[(1E)-2-(4-hydroxyphenyl)ethenyl]-phenyl)-2-methyl-1-propanone|1-{2,4-dihydroxy-6-[(1E)-2-(4-hydroxyphenyl)ethenyl]phenyl}-2-methyl-1-propanone

C18H18O4 (298.1205028)


   

2-(Methylamino)-3-oxo-3H-phenoxazine-8-carboxylic acid ethyl ester

2-(Methylamino)-3-oxo-3H-phenoxazine-8-carboxylic acid ethyl ester

C16H14N2O4 (298.0953524)


   

2-Benzoyl-5-(3-methyl-2-butenyloxy)resorcinol

2-Benzoyl-5-(3-methyl-2-butenyloxy)resorcinol

C18H18O4 (298.1205028)


   
   

(7S,8S)-2,4-dihydroxy-7,3-epoxy-8,4-oxyneolign-7-ene|4-[(2S,3S)-3-Methyl-7-((E)-1-propenyl)-2,3-dihydro-1,4-benzodioxin-2-yl]-1,3-benzenediol

(7S,8S)-2,4-dihydroxy-7,3-epoxy-8,4-oxyneolign-7-ene|4-[(2S,3S)-3-Methyl-7-((E)-1-propenyl)-2,3-dihydro-1,4-benzodioxin-2-yl]-1,3-benzenediol

C18H18O4 (298.1205028)


   

3-Prenyl-2,4,6-trihydroxybenzophenone

3-Prenyl-2,4,6-trihydroxybenzophenone

C18H18O4 (298.1205028)


   

3,4-Dehydrolarreatricin

3,4-Dehydrolarreatricin

C18H18O4 (298.1205028)


   

Dimethylcryptostrobin

Dimethylcryptostrobin

C18H18O4 (298.1205028)


   
   

2,3,6,7-tetramethoxyphenanthrene

2,3,6,7-tetramethoxyphenanthrene

C18H18O4 (298.1205028)


   

(+-)-1,1-Binaphthyl-carbonsaeure-8|(+-)-Binaphthyl-(1.1)-carbonsaeure-(8)|1,1-Binaphthyl-8-carbonsaeure|<1,1>Binaphthyl-8-carbonsaeure|Binaphthyl-(1.1)-carbonsaeure-(8)|[1,1]Binaphthyl-carbonsaeure-(8)|[1,1]binaphthyl-carboxylic acid-(8)

(+-)-1,1-Binaphthyl-carbonsaeure-8|(+-)-Binaphthyl-(1.1)-carbonsaeure-(8)|1,1-Binaphthyl-8-carbonsaeure|<1,1>Binaphthyl-8-carbonsaeure|Binaphthyl-(1.1)-carbonsaeure-(8)|[1,1]Binaphthyl-carbonsaeure-(8)|[1,1]binaphthyl-carboxylic acid-(8)

C21H14O2 (298.0993744)


   

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

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

C18H18O4 (298.1205028)


   
   

1,4-bis(2-hydroxy-5-methylphenyl)butane-1,4-dione

1,4-bis(2-hydroxy-5-methylphenyl)butane-1,4-dione

C18H18O4 (298.1205028)


   

2,3-O-Isopropylidene-3-Methyluridine

2,3-O-Isopropylidene-3-Methyluridine

C13H18N2O6 (298.1164808)


   

5-(erythro-1,2-dihydroxypropyl)-2-(4-hydroxyphenyl)-3-methylbenzofuran

5-(erythro-1,2-dihydroxypropyl)-2-(4-hydroxyphenyl)-3-methylbenzofuran

C18H18O4 (298.1205028)


   
   

(2-Acetyl-phenyl)-beta-D-glucopyranosid|(2-acetyl-phenyl)-beta-D-glucopyranoside|2-beta-D-glucopyranosyloxyacetophenone|2-glucopyranosyloxyacetophenone|acetophenone-2-O-beta-D-glucopyranoside|o-Acetylphenyl-beta-D-glucopyranosid

(2-Acetyl-phenyl)-beta-D-glucopyranosid|(2-acetyl-phenyl)-beta-D-glucopyranoside|2-beta-D-glucopyranosyloxyacetophenone|2-glucopyranosyloxyacetophenone|acetophenone-2-O-beta-D-glucopyranoside|o-Acetylphenyl-beta-D-glucopyranosid

C14H18O7 (298.10524780000003)


   
   

(4S,6S,10S)-10-bromo-3,11,11-trimethyl-7-methylidenespiro[5.5]undec-2-en-4-ol

(4S,6S,10S)-10-bromo-3,11,11-trimethyl-7-methylidenespiro[5.5]undec-2-en-4-ol

C15H23BrO (298.0932168)


   

1,2-Diphenylquinazolin-4(1H)-one

1,2-Diphenylquinazolin-4(1H)-one

C20H14N2O (298.1106074)


   

O1-((S)-1Phenyl-aethyl)-beta-D-glucopyranuronsaeure|O1-((S)-1phenyl-ethyl)-beta-D-glucopyranuronic acid

O1-((S)-1Phenyl-aethyl)-beta-D-glucopyranuronsaeure|O1-((S)-1phenyl-ethyl)-beta-D-glucopyranuronic acid

C14H18O7 (298.10524780000003)


   

7-hydroxy-deoxynybomycin

7-hydroxy-deoxynybomycin

C16H14N2O4 (298.0953524)


   

2-C-methyl-D-erythritol 3-O-beta-D-glucopyranoside|2-C-Methyl-D-erythritol 3-O-??-D-glucopyranoside

2-C-methyl-D-erythritol 3-O-beta-D-glucopyranoside|2-C-Methyl-D-erythritol 3-O-??-D-glucopyranoside

C11H22O9 (298.1263762)


   

2,6-dimethylphenol glucuronide|O1-(2,6-dimethyl-phenyl)-beta-D-glucopyranuronic acid|O1-(2,6-Dimethyl-phenyl)-beta-D-glucopyranuronsaeure

2,6-dimethylphenol glucuronide|O1-(2,6-dimethyl-phenyl)-beta-D-glucopyranuronic acid|O1-(2,6-Dimethyl-phenyl)-beta-D-glucopyranuronsaeure

C14H18O7 (298.10524780000003)


   
   

amentotaxin WB|rel-(3R,3aS,10bR)-3a,4,6,10b-tetrahydro-5-hydroxy-3,6,6-trimethyl-2H-benzo[5,6]indeno[1,2-b]furan-2,7(3G)-dione

amentotaxin WB|rel-(3R,3aS,10bR)-3a,4,6,10b-tetrahydro-5-hydroxy-3,6,6-trimethyl-2H-benzo[5,6]indeno[1,2-b]furan-2,7(3G)-dione

C18H18O4 (298.1205028)


   

2,3,4,7-tetramethoxyphenanthrene

2,3,4,7-tetramethoxyphenanthrene

C18H18O4 (298.1205028)


   

2,6-Dimethoxy-1-phenazinecarboxylic acid methyl ester

2,6-Dimethoxy-1-phenazinecarboxylic acid methyl ester

C16H14N2O4 (298.0953524)


   

2-C-methyl-D-erythritol 4-O-beta-D-fructofuranoside|2-C-Methyl-D-erythritol 4-O-??-D-fructofuranoside

2-C-methyl-D-erythritol 4-O-beta-D-fructofuranoside|2-C-Methyl-D-erythritol 4-O-??-D-fructofuranoside

C11H22O9 (298.1263762)


   

2,2,4-trimethyl-6-(1-oxo-3-phenylprop-2-enyl)cyclohexane-1,3,5-trione|5-hydroxydesmosdumotin C|champanone B

2,2,4-trimethyl-6-(1-oxo-3-phenylprop-2-enyl)cyclohexane-1,3,5-trione|5-hydroxydesmosdumotin C|champanone B

C18H18O4 (298.1205028)


   
   

10-Brom-alpha-qamigren-4-on

10-Brom-alpha-qamigren-4-on

C15H23BrO (298.0932168)


   
   
   
   

Di-Ac-4,6-Tetradecadiene-8,10,12-triyne-1,3-diol,

Di-Ac-4,6-Tetradecadiene-8,10,12-triyne-1,3-diol,

C18H18O4 (298.1205028)


   

2-trans-Cinnamoyl-3-hydroxy-5-methoxy-6,6-dimethyl-cyclohexa-2,4-dienon|2-trans-cinnamoyl-3-hydroxy-5-methoxy-6,6-dimethyl-cyclohexa-2,4-dienone|4-Hydroxy-6-methoxy-1.1-dimethyl-3-trans-cinnamoyl-cyclohexadien-(3.5)-on-(2)|ceroptene

2-trans-Cinnamoyl-3-hydroxy-5-methoxy-6,6-dimethyl-cyclohexa-2,4-dienon|2-trans-cinnamoyl-3-hydroxy-5-methoxy-6,6-dimethyl-cyclohexa-2,4-dienone|4-Hydroxy-6-methoxy-1.1-dimethyl-3-trans-cinnamoyl-cyclohexadien-(3.5)-on-(2)|ceroptene

C18H18O4 (298.1205028)


   
   

(6R)-5beta-(6,7-dihydroxyethyl)-4-(5-hydroxymethyl-furan-2-yl-methylene)-2beta-ethoxy-dihydrofuran-3-one|pollenfuran B

(6R)-5beta-(6,7-dihydroxyethyl)-4-(5-hydroxymethyl-furan-2-yl-methylene)-2beta-ethoxy-dihydrofuran-3-one|pollenfuran B

C14H18O7 (298.10524780000003)


   
   

(2R)-hydroxy-norneomajucin|11-nor-(2R)-hydroxyneomajucin

(2R)-hydroxy-norneomajucin|11-nor-(2R)-hydroxyneomajucin

C14H18O7 (298.10524780000003)


   

Isocorniculatolide A

Isocorniculatolide A

C18H18O4 (298.1205028)


   

5-allyl-5-(1-hydroxyallyloxy)biphenyl-2,2-diol

5-allyl-5-(1-hydroxyallyloxy)biphenyl-2,2-diol

C18H18O4 (298.1205028)


   

1,1-diallylbiphenyl-4,4,5,5-tetraol

1,1-diallylbiphenyl-4,4,5,5-tetraol

C18H18O4 (298.1205028)


   
   
   
   
   

10-bromo-3,7,11,11-tetramethylspiro[5.5]undeca-1,7-dien-3-ol

10-bromo-3,7,11,11-tetramethylspiro[5.5]undeca-1,7-dien-3-ol

C15H23BrO (298.0932168)


   
   

2-Isobutyl-5-(1H-indole-3-yl)oxazole-4-carboxylic acid methyl ester

2-Isobutyl-5-(1H-indole-3-yl)oxazole-4-carboxylic acid methyl ester

C17H18N2O3 (298.1317358)


   

methyl 1-(propionic acid)-beta-carboline-3-carboxylate

methyl 1-(propionic acid)-beta-carboline-3-carboxylate

C16H14N2O4 (298.0953524)


   

(E)-9-(3,4-dimethylpent-2-enyloxy)-7H-furo[3,2-g]chromen-7-one

(E)-9-(3,4-dimethylpent-2-enyloxy)-7H-furo[3,2-g]chromen-7-one

C18H18O4 (298.1205028)


   
   

1,4,10-Trimethoxyanthracene-2-methanol

1,4,10-Trimethoxyanthracene-2-methanol

C18H18O4 (298.1205028)


   
   
   

1,1,7-Trimethyl-3-methoxy-6,9-dihydroxy-1,2-dihydrophenanthrene-2-one

1,1,7-Trimethyl-3-methoxy-6,9-dihydroxy-1,2-dihydrophenanthrene-2-one

C18H18O4 (298.1205028)


   

O1-(2,4-dimethyl-phenyl)-beta-D-glucopyranuronic acid|O1-(2,4-Dimethyl-phenyl)-beta-D-glucopyranuronsaeure

O1-(2,4-dimethyl-phenyl)-beta-D-glucopyranuronic acid|O1-(2,4-Dimethyl-phenyl)-beta-D-glucopyranuronsaeure

C14H18O7 (298.10524780000003)


   
   
   

O1-(3,5-dimethyl-phenyl)-beta-D-glucopyranuronic acid|O1-(3,5-Dimethyl-phenyl)-beta-D-glucopyranuronsaeure

O1-(3,5-dimethyl-phenyl)-beta-D-glucopyranuronic acid|O1-(3,5-Dimethyl-phenyl)-beta-D-glucopyranuronsaeure

C14H18O7 (298.10524780000003)


   

(2R:3S)-2.3-Dihydroxy-2-(4-methoxy-benzyl)-bernsteinsaeure-dimethylester|(2R:3S)-2.3-dihydroxy-2-(4-methoxy-benzyl)-succinic acid dimethyl ester|4-O-methyl-piscidic acid dimethyl ester

(2R:3S)-2.3-Dihydroxy-2-(4-methoxy-benzyl)-bernsteinsaeure-dimethylester|(2R:3S)-2.3-dihydroxy-2-(4-methoxy-benzyl)-succinic acid dimethyl ester|4-O-methyl-piscidic acid dimethyl ester

C14H18O7 (298.10524780000003)


   
   

Tetra-Me ether-1,5-Di-Me ether-1,2,5,7-Tetrahydroxyphenanthrene

Tetra-Me ether-1,5-Di-Me ether-1,2,5,7-Tetrahydroxyphenanthrene

C18H18O4 (298.1205028)


   

2-C-methyl-D-erythritol 3-O-beta-D-fructofuranoside|2-C-Methyl-D-erythritol 3-O-??-D-fructofuranoside

2-C-methyl-D-erythritol 3-O-beta-D-fructofuranoside|2-C-Methyl-D-erythritol 3-O-??-D-fructofuranoside

C11H22O9 (298.1263762)


   

2-C-methyl-D-erythritol 1-O-beta-D-glucopyranoside|2-C-Methyl-D-erythritol 1-O-??-D-glucopyranoside

2-C-methyl-D-erythritol 1-O-beta-D-glucopyranoside|2-C-Methyl-D-erythritol 1-O-??-D-glucopyranoside

C11H22O9 (298.1263762)


   

2,9-Dimethoxy-1-phenazinecarboxylic acid methyl ester

2,9-Dimethoxy-1-phenazinecarboxylic acid methyl ester

C16H14N2O4 (298.0953524)


   

2-C-methyl-D-erythritol 1-O-beta-D-fructofuranoside|2-C-Methyl-D-erythritol 1-O-??-D-fructofuranoside

2-C-methyl-D-erythritol 1-O-beta-D-fructofuranoside|2-C-Methyl-D-erythritol 1-O-??-D-fructofuranoside

C11H22O9 (298.1263762)


   
   

2-Phenyl-5,7,8-trimethoxy-2H-1-benzopyran

2-Phenyl-5,7,8-trimethoxy-2H-1-benzopyran

C18H18O4 (298.1205028)


   

O1-(2,3-dimethyl-phenyl)-beta-D-glucopyranuronic acid|O1-(2,3-Dimethyl-phenyl)-beta-D-glucopyranuronsaeure

O1-(2,3-dimethyl-phenyl)-beta-D-glucopyranuronic acid|O1-(2,3-Dimethyl-phenyl)-beta-D-glucopyranuronsaeure

C14H18O7 (298.10524780000003)


   
   

Corniculatolide A

Corniculatolide A

C18H18O4 (298.1205028)


   
   
   
   

12-chloroillicinone E

12-chloroillicinone E

C15H19ClO4 (298.0971804)


   

O1-(3,4-dimethyl-phenyl)-beta-D-glucopyranuronic acid|O1-(3,4-Dimethyl-phenyl)-beta-D-glucopyranuronsaeure

O1-(3,4-dimethyl-phenyl)-beta-D-glucopyranuronic acid|O1-(3,4-Dimethyl-phenyl)-beta-D-glucopyranuronsaeure

C14H18O7 (298.10524780000003)


   

2,5-dimethylphenol glucuronide|O1-(2,5-dimethyl-phenyl)-beta-D-glucopyranuronic acid|O1-(2,5-Dimethyl-phenyl)-beta-D-glucopyranuronsaeure

2,5-dimethylphenol glucuronide|O1-(2,5-dimethyl-phenyl)-beta-D-glucopyranuronic acid|O1-(2,5-Dimethyl-phenyl)-beta-D-glucopyranuronsaeure

C14H18O7 (298.10524780000003)


   

2-C-methyl-D-erythritol 4-O-beta-D-glucopyranoside|2-C-Methyl-D-erythritol 4-O-??-D-glucopyranoside

2-C-methyl-D-erythritol 4-O-beta-D-glucopyranoside|2-C-Methyl-D-erythritol 4-O-??-D-glucopyranoside

C11H22O9 (298.1263762)


   
   
   

2,4-Dihydroxy-3,7:4,8-diepoxylign-7-ene

4-[2-methyl-6-[(E)-prop-1-enyl]-2,3-dihydro-1,4-benzodioxin-3-yl]benzene-1,3-diol

C18H18O4 (298.1205028)


   

Phenethyl ferulate

2-Propenoic acid, 3-(4-hydroxy-3-methoxyphenyl)-, 2-phenylethyl ester, (2E)-

C18H18O4 (298.1205028)


Phenylethyl 3-methylcaffeate is a natural product found in Hansenia forbesii, Hansenia weberbaueriana, and Propolis with data available. Phenethyl ferulate is a major constituent ofQianghuo, shows inhibitory activity against cyclooxygenase (COX) and 5-lipoxygenase (5-LOX) with IC50 values of 4.35 μM and 5.75 μM, respectively[1]. Phenethyl ferulate is a major constituent ofQianghuo, shows inhibitory activity against cyclooxygenase (COX) and 5-lipoxygenase (5-LOX) with IC50 values of 4.35 μM and 5.75 μM, respectively[1]. Phenethyl ferulate is a major constituent ofQianghuo, shows inhibitory activity against cyclooxygenase (COX) and 5-lipoxygenase (5-LOX) with IC50 values of 4.35 μM and 5.75 μM, respectively[1].

   

N-{[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]amino}(3-methoxyphenyl)carboxamide

N-{[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]amino}(3-methoxyphenyl)carboxamide

C13H18N2O6 (298.1164808)


relative retention time with respect to 9-anthracene Carboxylic Acid is 0.393 relative retention time with respect to 9-anthracene Carboxylic Acid is 0.395

   

7-Methylguanosine

7-Methylguanosine

C11H16N5O5+ (298.1151386)


A positively charged methylguanosine in which a single methyl substituent is located at position 7.

   

amlexanox

2-amino-5-oxo-7-(propan-2-yl)-5H-chromeno[2,3-b]pyridine-3-carboxylic acid

C16H14N2O4 (298.0953524)


A - Alimentary tract and metabolism > A01 - Stomatological preparations > A01A - Stomatological preparations C308 - Immunotherapeutic Agent > C29578 - Histamine-1 Receptor Antagonist R - Respiratory system > R03 - Drugs for obstructive airway diseases D018926 - Anti-Allergic Agents

   

Enterolactone

3,4-Bis((3-hydroxyphenyl)methyl)dihydro-2-(3H)-furanone

C18H18O4 (298.1205028)


D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones > D004967 - Estrogens CONFIDENCE standard compound; INTERNAL_ID 483; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3951; ORIGINAL_PRECURSOR_SCAN_NO 3949 CONFIDENCE standard compound; INTERNAL_ID 483; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3959; ORIGINAL_PRECURSOR_SCAN_NO 3958 CONFIDENCE standard compound; INTERNAL_ID 483; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3921; ORIGINAL_PRECURSOR_SCAN_NO 3919 CONFIDENCE standard compound; INTERNAL_ID 483; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3952; ORIGINAL_PRECURSOR_SCAN_NO 3950 CONFIDENCE standard compound; INTERNAL_ID 483; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3939; ORIGINAL_PRECURSOR_SCAN_NO 3935 CONFIDENCE standard compound; INTERNAL_ID 483; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3939; ORIGINAL_PRECURSOR_SCAN_NO 3937 Annotation level-1

   

N2-Pyridyloxobutyl-guanine

N2-Pyridyloxobutyl-guanine

C14H14N6O2 (298.1178184)


   

N2-[4-oxo-4-(3-pyridyl)but-2-yl-guanine

N2-[4-oxo-4-(3-pyridyl)but-2-yl-guanine

C14H14N6O2 (298.1178184)


   

O6-Pyridyloxobutyl-guanine

O6-Pyridyloxobutyl-guanine

C14H14N6O2 (298.1178184)


   
   
   

2-Furanpropanoic acid, tetrahydro-4-(1-naphthalenylmethyl)-5-oxo-

2-Furanpropanoic acid, tetrahydro-4-(1-naphthalenylmethyl)-5-oxo-

C18H18O4 (298.1205028)


   

5-(4-Hydroxy-3-methoxyphenyl)-5-phenylhydantoin

5-(4-Hydroxy-3-methoxyphenyl)-5-phenylhydantoin

C16H14N2O4 (298.0953524)


   

(+)-6,8-Di-C-methylpinocembrin 5-methyl ether

(+)-6,8-Di-C-methylpinocembrin 5-methyl ether

C18H18O4 (298.1205028)


   

5,7-Dimethoxy-6-C-methylflavanone

5,7-Dimethoxy-6-C-methylflavanone

C18H18O4 (298.1205028)


   

2-Phenylethanol glucuronide

2-Phenylethanol glucuronoside

C14H18O7 (298.10524780000003)


   
   
   
   

(+)-Ligballinol

4-[4-(4-hydroxyphenyl)-hexahydrofuro[3,4-c]furan-1-yl]phenol

C18H18O4 (298.1205028)


   

8-Deoxy-11-hydroxy-13-chlorogrosheimin

3-(chloromethyl)-3-hydroxy-9-methyl-6-methylidene-dodecahydroazuleno[4,5-b]furan-2,8-dione

C15H19ClO4 (298.0971804)


   

(2S)-7-hydroxy-5-methoxy-6,8-dimethylflavanone

(2S)-7-hydroxy-5-methoxy-6,8-dimethylflavanone

C18H18O4 (298.1205028)


   

4-(bromomethyl)-2,6-ditert-butyl-phenol

4-(bromomethyl)-2,6-ditert-butyl-phenol

C15H23BrO (298.0932168)


   

2-tert-Butoxycarbonylamino-4,5,6,7-tetrahydro-benzothiazole-4-carboxylic acid

2-tert-Butoxycarbonylamino-4,5,6,7-tetrahydro-benzothiazole-4-carboxylic acid

C13H18N2O4S (298.0987228)


   

4-Methoxyphenyl 4-(3-Butenyloxy)benzoate

4-Methoxyphenyl 4-(3-Butenyloxy)benzoate

C18H18O4 (298.1205028)


   

5-(1,2-DIHYDROXY-2-(PYRIDIN-4-YL)ETHYL)-2,3-DIHYDRO-1H-INDEN-1-ONE O-METHYL OXIME

5-(1,2-DIHYDROXY-2-(PYRIDIN-4-YL)ETHYL)-2,3-DIHYDRO-1H-INDEN-1-ONE O-METHYL OXIME

C17H18N2O3 (298.1317358)


   

methyl 2-(8-fluoro-3,4-dihydro-1H-pyrido[4,3-b]indol-5(2H)-yl)acetate hydrochloride

methyl 2-(8-fluoro-3,4-dihydro-1H-pyrido[4,3-b]indol-5(2H)-yl)acetate hydrochloride

C14H16ClFN2O2 (298.0884278)


   

Diglycidyl 4,5-epoxycyclohexane-1,2-dicarboxylate

Diglycidyl 4,5-epoxycyclohexane-1,2-dicarboxylate

C14H18O7 (298.10524780000003)


   

4,4-(1,4-Butanediyl)dioxydibenzaldehyde

4,4-(1,4-Butanediyl)dioxydibenzaldehyde

C18H18O4 (298.1205028)


   
   

Ivachtin

Metadoxine

C13H18N2O6 (298.1164808)


A - Alimentary tract and metabolism > A05 - Bile and liver therapy > A05B - Liver therapy, lipotropics > A05BA - Liver therapy D002491 - Central Nervous System Agents > D000427 - Alcohol Deterrents

   

tert-Butyl 4-(2-chloropyrimidin-4-yl)piperazine-1-carboxylate

tert-Butyl 4-(2-chloropyrimidin-4-yl)piperazine-1-carboxylate

C13H19ClN4O2 (298.11964639999997)


   

tert-Butyl 4-(4-chloropyrimidin-2-yl)piperazine-1-carboxylate

tert-Butyl 4-(4-chloropyrimidin-2-yl)piperazine-1-carboxylate

C13H19ClN4O2 (298.11964639999997)


   

1-Boc-4-(6-Chloropyridazin-3-yl)piperazine

1-Boc-4-(6-Chloropyridazin-3-yl)piperazine

C13H19ClN4O2 (298.11964639999997)


   

2-N,N-METHYLACETYLAMINO-5-NITROBENOPHENONE

2-N,N-METHYLACETYLAMINO-5-NITROBENOPHENONE

C16H14N2O4 (298.0953524)


   

1,2-BINAPHTHALEN]-4-YLBORONIC ACID

1,2-BINAPHTHALEN]-4-YLBORONIC ACID

C20H15BO2 (298.11650399999996)


   

diethyldimethylplumbane

diethyldimethylplumbane

C6H18Pb (298.1174838)


   

2,2’-(1,4-Butanediyldioxy)bisbenzaldehyde

2,2’-(1,4-Butanediyldioxy)bisbenzaldehyde

C18H18O4 (298.1205028)


   
   

4-[2-(2-Amino-4,7-dihydro-4-oxo-1H-pymol[2,3-d]pyrimodin-5-yl)ethyl]benzoic acid

4-[2-(2-Amino-4,7-dihydro-4-oxo-1H-pymol[2,3-d]pyrimodin-5-yl)ethyl]benzoic acid

C15H14N4O3 (298.1065854)


   

4-TRIFLUOROMETHYL-TRANS-BETA-STYRYLBORONIC ACID PINACOL ESTER

4-TRIFLUOROMETHYL-TRANS-BETA-STYRYLBORONIC ACID PINACOL ESTER

C15H18BF3O2 (298.1351874)


   

1-butyl-2,3-dimethylimidazol-3-ium,hexafluorophosphate

1-butyl-2,3-dimethylimidazol-3-ium,hexafluorophosphate

C9H17F6N2P (298.1033484)


   

3-AMINO-3-[5-(2-TRIFLUOROMETHYLPHENYL)-FURAN-2-YL]-PROPIONIC ACID AMIDE

3-AMINO-3-[5-(2-TRIFLUOROMETHYLPHENYL)-FURAN-2-YL]-PROPIONIC ACID AMIDE

C14H13F3N2O2 (298.0929074)


   

octane-1,8-diylbis(chlorodimethylsilane)

octane-1,8-diylbis(chlorodimethylsilane)

C12H28Cl2Si2 (298.11065080000003)


   

3-(4-CHLOROPHENYL)-1-(4-ISOBUTYLPHENYL)PROP-2-EN-1-ONE

3-(4-CHLOROPHENYL)-1-(4-ISOBUTYLPHENYL)PROP-2-EN-1-ONE

C19H19ClO (298.1124354)


   

E-2-(3-Trifluoromethylphenyl)vinylboronic acid pinacol ester

E-2-(3-Trifluoromethylphenyl)vinylboronic acid pinacol ester

C15H18BF3O2 (298.1351874)


   

8-Benzoyl-5,7-dihydroxy-2,2-diMethylchroMane

8-Benzoyl-5,7-dihydroxy-2,2-diMethylchroMane

C18H18O4 (298.1205028)


   

2,5-DIOXOPYRROLIDIN-1-YL 2,6-DIMETHYLQUINOLINE-4-CARBOXYLATE

2,5-DIOXOPYRROLIDIN-1-YL 2,6-DIMETHYLQUINOLINE-4-CARBOXYLATE

C16H14N2O4 (298.0953524)


   

s-n-(-)-p-tolylsulfinyltryptamine 97

s-n-(-)-p-tolylsulfinyltryptamine 97

C17H18N2OS (298.11397780000004)


   

2-(3-Chloro-5-(methoxymethoxy)phenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

2-(3-Chloro-5-(methoxymethoxy)phenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

C14H20BClO4 (298.11431000000005)


   

3-(2-(Pyrrolidin-1-yl)ethylcarbamoyl)phenylboronic acid, HCl

3-(2-(Pyrrolidin-1-yl)ethylcarbamoyl)phenylboronic acid, HCl

C13H20BClN2O3 (298.125543)


   

AZOBENZENE-4,4-DICARBOXYLIC ACID DIMETHYL ESTER

AZOBENZENE-4,4-DICARBOXYLIC ACID DIMETHYL ESTER

C16H14N2O4 (298.0953524)


   

3-(3,4-dichlorophenyl)-3,9-diazaspiro[5.5]undecane

3-(3,4-dichlorophenyl)-3,9-diazaspiro[5.5]undecane

C15H20Cl2N2 (298.100346)


   

3-(2,3-dichlorophenyl)-3,9-diazaspiro[5.5]undecane

3-(2,3-dichlorophenyl)-3,9-diazaspiro[5.5]undecane

C15H20Cl2N2 (298.100346)


   

TERT-BUTYL 2-(3-OXOISOINDOLIN-4-YL)-1H-PYRROLE-1-CARBOXYLATE

TERT-BUTYL 2-(3-OXOISOINDOLIN-4-YL)-1H-PYRROLE-1-CARBOXYLATE

C17H18N2O3 (298.1317358)


   

[3-[(2-oxido-4-phenyl-1,2,5-oxadiazol-2-ium-3-yl)methoxy]phenyl]methanol

[3-[(2-oxido-4-phenyl-1,2,5-oxadiazol-2-ium-3-yl)methoxy]phenyl]methanol

C16H14N2O4 (298.0953524)


   

[4-[(2-oxido-4-phenyl-1,2,5-oxadiazol-2-ium-3-yl)methoxy]phenyl]methanol

[4-[(2-oxido-4-phenyl-1,2,5-oxadiazol-2-ium-3-yl)methoxy]phenyl]methanol

C16H14N2O4 (298.0953524)


   

(4-((2-(PYRROLIDIN-1-YL)ETHYL)CARBAMOYL)PHENYL)BORONIC ACID HYDROCHLORIDE

(4-((2-(PYRROLIDIN-1-YL)ETHYL)CARBAMOYL)PHENYL)BORONIC ACID HYDROCHLORIDE

C13H20BClN2O3 (298.125543)


   

3-(4-METHYLPIPERAZIN-1-YL)-4-(METHYLSULFONYL)BENZOIC ACID

3-(4-METHYLPIPERAZIN-1-YL)-4-(METHYLSULFONYL)BENZOIC ACID

C13H18N2O4S (298.0987228)


   

[4-(6-FORMYLPYRIDIN-2-YL)PHENYL]CARBAMIC ACID TERT-BUTYL ESTER

[4-(6-FORMYLPYRIDIN-2-YL)PHENYL]CARBAMIC ACID TERT-BUTYL ESTER

C17H18N2O3 (298.1317358)


   

3-[(3-nitrophenyl)methyl]-1,6,7,8-tetrahydroquinoline-2,5-dione

3-[(3-nitrophenyl)methyl]-1,6,7,8-tetrahydroquinoline-2,5-dione

C16H14N2O4 (298.0953524)


   
   

2,4,4-TRIMETHOXYCHALCONE

2,4,4-TRIMETHOXYCHALCONE

C18H18O4 (298.1205028)


   

4-methyl-1-(4-methyl-3-nitrophenyl)sulfonylpiperidine

4-methyl-1-(4-methyl-3-nitrophenyl)sulfonylpiperidine

C13H18N2O4S (298.0987228)


   

METHYL 3,4-DIFLUORO-5-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)BENZOATE

METHYL 3,4-DIFLUORO-5-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)BENZOATE

C14H17BF2O4 (298.1187896)


   

piprozolin

Piprozoline

C14H22N2O3S (298.1351062)


C78276 - Agent Affecting Digestive System or Metabolism > C66913 - Cholagogues or Choleretic Agents A - Alimentary tract and metabolism > A05 - Bile and liver therapy > A05A - Bile therapy

   
   
   

Trastuzumab

2,8-Diamino-9-(3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)-1H-purin-6(9H)-one

C10H14N6O5 (298.1025634)


D007155 - Immunologic Factors > D007166 - Immunosuppressive Agents D002317 - Cardiovascular Agents > D045283 - Natriuretic Agents D045283 - Natriuretic Agents > D004232 - Diuretics D004791 - Enzyme Inhibitors

   
   

4-METHYL-2-[3-(1H-PYRROL-1-YL)PHENYL]-1,3-THIAZOLE-5-CARBOHYDRAZIDE

4-METHYL-2-[3-(1H-PYRROL-1-YL)PHENYL]-1,3-THIAZOLE-5-CARBOHYDRAZIDE

C15H14N4OS (298.0888274)


   

5-AMINO-3,3-DIMETHYL-1-TOSYLPIPERIDIN-4-OL

5-AMINO-3,3-DIMETHYL-1-TOSYLPIPERIDIN-4-OL

C14H22N2O3S (298.1351062)


   

Diethyl 4,4-biphenyldicarboxylate

Diethyl 4,4-biphenyldicarboxylate

C18H18O4 (298.1205028)


   

tert-butyl 4-[4-(hydroxymethyl)-1,3-thiazol-2-yl]piperidine-1-carboxylate

tert-butyl 4-[4-(hydroxymethyl)-1,3-thiazol-2-yl]piperidine-1-carboxylate

C14H22N2O3S (298.1351062)


   

(4R)-4-PHENYL-3-(1,2-PROPADIENYL)-2-OXAZOLIDINONE

(4R)-4-PHENYL-3-(1,2-PROPADIENYL)-2-OXAZOLIDINONE

C16H14N2O4 (298.0953524)


   
   

N-(5-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)PYRIDIN-2-YL)ACETAMIDE HYDROCHLORIDE

N-(5-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)PYRIDIN-2-YL)ACETAMIDE HYDROCHLORIDE

C13H20BClN2O3 (298.125543)


   

Metochalcone [DCF:INN]

Metochalcone [DCF:INN]

C18H18O4 (298.1205028)


   

5-Bromo-1,3-di-tert-butyl-2-methoxybenzene

5-Bromo-1,3-di-tert-butyl-2-methoxybenzene

C15H23BrO (298.0932168)


   

salicylaldehyde carbohydrazone

salicylaldehyde carbohydrazone

C15H14N4O3 (298.1065854)


   

2-[(4-Chlorophenyl)(1-methyl-4-piperidinylidene)methyl]pyridine

2-[(4-Chlorophenyl)(1-methyl-4-piperidinylidene)methyl]pyridine

C18H19ClN2 (298.1236684)


   

6-isoquinolin-5-ylnaphthalene-1-carboxamide

6-isoquinolin-5-ylnaphthalene-1-carboxamide

C20H14N2O (298.1106074)


   

1-(2-Methylphenyl)-9,10-anthracenedione

1-(2-Methylphenyl)-9,10-anthracenedione

C21H14O2 (298.0993744)


   

(Z)-2-(2-tert-Butoxycarbonylaminothiazol-4-yl)-2-pentenoic acid

(Z)-2-(2-tert-Butoxycarbonylaminothiazol-4-yl)-2-pentenoic acid

C13H18N2O4S (298.0987228)


   

Dibenzyl-(E)-diazen-1,2-dicarboxylat

Dibenzyl-(E)-diazen-1,2-dicarboxylat

C16H14N2O4 (298.0953524)


   

3-indoxyl choline phosphate

3-indoxyl choline phosphate

C13H19N2O4P (298.1082384)


   

tert-butyl 4-(3-chloropyrazin-2-yl)piperazine-1-carboxylate

tert-butyl 4-(3-chloropyrazin-2-yl)piperazine-1-carboxylate

C13H19ClN4O2 (298.11964639999997)


   

1a,6a-diphenylindeno[1,2-b]oxiren-6-one

1a,6a-diphenylindeno[1,2-b]oxiren-6-one

C21H14O2 (298.0993744)


   

6-Benzoyl-5,7-dihydroxy-2,2-diMethylchroMane

6-Benzoyl-5,7-dihydroxy-2,2-diMethylchroMane

C18H18O4 (298.1205028)


   

tert-Butyl 4-(6-chloropyrimidin-4-yl)piperazine-1-carboxylate

tert-Butyl 4-(6-chloropyrimidin-4-yl)piperazine-1-carboxylate

C13H19ClN4O2 (298.11964639999997)


   

Bis(2,2-diethoxyethyl) Disulfide

Bis(2,2-diethoxyethyl) Disulfide

C12H26O4S2 (298.1272436)


   

2-(4-BIPHENYLYL)-5-PHENYL-1,3,4-OXADIAZOLE

2-(4-BIPHENYLYL)-5-PHENYL-1,3,4-OXADIAZOLE

C20H14N2O (298.1106074)


   

2-[1,4]Diazepan-1-yl-5-propyl-benzenesulfonic acid

2-[1,4]Diazepan-1-yl-5-propyl-benzenesulfonic acid

C14H22N2O3S (298.1351062)


   

N-(4-ethoxyphenyl)-4-oxo-1,5,6,7-tetrahydroindole-3-carboxamide

N-(4-ethoxyphenyl)-4-oxo-1,5,6,7-tetrahydroindole-3-carboxamide

C17H18N2O3 (298.1317358)


   

3-(Boc-amino)-3-(4-fluorophenyl)-N-hydroxypropanamide

3-(Boc-amino)-3-(4-fluorophenyl)-N-hydroxypropanamide

C14H19FN2O4 (298.1328786)


   

2-AMINO-4,7-DIHYDRO-5H-THIENO[2,3-C]PYRIDINE-3,6-DICARBOXYLICACID3,6-DIETHYLESTER

2-AMINO-4,7-DIHYDRO-5H-THIENO[2,3-C]PYRIDINE-3,6-DICARBOXYLICACID3,6-DIETHYLESTER

C13H18N2O4S (298.0987228)


   

tert-butyl 4-(6-chloropyrazin-2-yl)piperazine-1-carboxylate

tert-butyl 4-(6-chloropyrazin-2-yl)piperazine-1-carboxylate

C13H19ClN4O2 (298.11964639999997)


   

N-(5-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)PYRIDIN-3-YL)METHANESULFONAMIDE

N-(5-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)PYRIDIN-3-YL)METHANESULFONAMIDE

C12H19BN2O4S (298.11585240000005)


   

6-tert-butoxycarbonyl-4,5,7,8-tetrahydrothiazolo[4,5-d]azepine-2- carboxylic acid

6-tert-butoxycarbonyl-4,5,7,8-tetrahydrothiazolo[4,5-d]azepine-2- carboxylic acid

C13H18N2O4S (298.0987228)


   

DIETHYL BIPHENYL 2,2-DICARBOXYLATE

DIETHYL BIPHENYL 2,2-DICARBOXYLATE

C18H18O4 (298.1205028)


   

4,4-bis(2,3-epoxypropoxy)biphenyl

4,4-bis(2,3-epoxypropoxy)biphenyl

C18H18O4 (298.1205028)


   

1,1,1,3,5,5,5-Heptamethyl-3-phenyltrisiloxane

1,1,1,3,5,5,5-Heptamethyl-3-phenyltrisiloxane

C13H26O2Si3 (298.1240536)


   

Nα-[(Benzyloxy)carbonyl]-D-phenylalaninamide

Nα-[(Benzyloxy)carbonyl]-D-phenylalaninamide

C17H18N2O3 (298.1317358)


   

4-oxo-4-(2-oxo-1,2-diphenylethoxy)butanoic acid

4-oxo-4-(2-oxo-1,2-diphenylethoxy)butanoic acid

C18H18O4 (298.1205028)


   

Alcohol dehydrogenase

Alcohol dehydrogenase

C17H18N2O3 (298.1317358)


   

methyl O6-benzoyl-β-D-glucoside

methyl O6-benzoyl-β-D-glucoside

C14H18O7 (298.10524780000003)


   

(10-Phenylanthracen-9-yl)boronic acid

(10-Phenylanthracen-9-yl)boronic acid

C20H15BO2 (298.11650399999996)


   
   

Benzo[1,3]dioxole-5-carboxylic acid Methyl-piperidin-4-yl-aMide hydrochloride

Benzo[1,3]dioxole-5-carboxylic acid Methyl-piperidin-4-yl-aMide hydrochloride

C14H19ClN2O3 (298.1084134)


   

2-(4-ethylpiperazin-1-ylsulfonyl)phenylboronic acid

2-(4-ethylpiperazin-1-ylsulfonyl)phenylboronic acid

C12H19BN2O4S (298.11585240000005)


   

2-trifluoromethyl-trans-beta-styrylboronic acid pinacol ester

2-trifluoromethyl-trans-beta-styrylboronic acid pinacol ester

C15H18BF3O2 (298.1351874)


   

Boronic acid, B-​[4-​[(4-​ethyl-​1-​piperazinyl)​sulfonyl]​phenyl]​-

Boronic acid, B-​[4-​[(4-​ethyl-​1-​piperazinyl)​sulfonyl]​phenyl]​-

C12H19BN2O4S (298.11585240000005)


   

B-[1,1-Binaphthalen]-4-ylboronic acid

B-[1,1-Binaphthalen]-4-ylboronic acid

C20H15BO2 (298.11650399999996)


   
   

1-[3,5-Bis(trifluoromethyl)phenyl]piperazine

1-[3,5-Bis(trifluoromethyl)phenyl]piperazine

C12H12F6N2 (298.0904624)


   

9-benzotriazole-1-ylmethyl-9H-carbazole

9-benzotriazole-1-ylmethyl-9H-carbazole

C19H14N4 (298.1218404)


   

Benzenepropanoic acid, b-hydroxy-b-phenyl-, 2-acetylhydrazide

Benzenepropanoic acid, b-hydroxy-b-phenyl-, 2-acetylhydrazide

C17H18N2O3 (298.1317358)


   

Methyl 3,5-difluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoate

Methyl 3,5-difluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoate

C14H17BF2O4 (298.1187896)


   

Pamiparib

Pamiparib

C16H15FN4O (298.12298319999996)


L - Antineoplastic and immunomodulating agents > L01 - Antineoplastic agents > L01X - Other antineoplastic agents > L01XK - Poly (adp-ribose) polymerase (parp) inhibitors C274 - Antineoplastic Agent > C163758 - Targeted Therapy Agent > C62554 - Poly (ADP-Ribose) Polymerase Inhibitor D000970 - Antineoplastic Agents > D000067856 - Poly(ADP-ribose) Polymerase Inhibitors D004791 - Enzyme Inhibitors C471 - Enzyme Inhibitor

   

6,11-Dihydro-11-ethyl-6-methyl-9-nitro-5H-pyrido[2,3-B][1,5]benzodiazepin-5-one

6,11-Dihydro-11-ethyl-6-methyl-9-nitro-5H-pyrido[2,3-B][1,5]benzodiazepin-5-one

C15H14N4O3 (298.1065854)


   

Ethyl 8-hydroxy-alpha-(2-propynylamino)-5-quinolinepropanoate

Ethyl 8-hydroxy-alpha-(2-propynylamino)-5-quinolinepropanoate

C17H18N2O3 (298.1317358)


   

(E)-4-methyl-6-(3-methyl-1,4-dioxonaphthalen-2-yl)hex-4-enoic acid

(E)-4-methyl-6-(3-methyl-1,4-dioxonaphthalen-2-yl)hex-4-enoic acid

C18H18O4 (298.1205028)


   

2-Hydroxy-3-(phosphonooxy)propyl octanoate

2-Hydroxy-3-(phosphonooxy)propyl octanoate

C11H23O7P (298.1181338)


   

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

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

C18H18O4 (298.1205028)


   

2-(6-(4-Chlorophenoxy)hexyl)oxirane-2-carboxylic acid

2-(6-(4-Chlorophenoxy)hexyl)oxirane-2-carboxylic acid

C15H19ClO4 (298.0971804)


   
   
   

3,4,5-Trimethoxybenzylidene acetophenone

3,4,5-Trimethoxybenzylidene acetophenone

C18H18O4 (298.1205028)


   

Isopropyl 2-amino-5-[(diethylamino)carbonyl]-4-methylthiophene-3-carboxylate

Isopropyl 2-amino-5-[(diethylamino)carbonyl]-4-methylthiophene-3-carboxylate

C14H22N2O3S (298.1351062)


   

N-(3,5-dimethylphenyl)-2-(2-nitroethyl)benzamide

N-(3,5-dimethylphenyl)-2-(2-nitroethyl)benzamide

C17H18N2O3 (298.1317358)


   

N-(2-furanylmethyl)-5-(3-methoxyphenyl)-3-isoxazolecarboxamide

N-(2-furanylmethyl)-5-(3-methoxyphenyl)-3-isoxazolecarboxamide

C16H14N2O4 (298.0953524)


   

2-[[2-(2-methylphenoxy)ethylthio]methyl]-1H-benzimidazole

2-[[2-(2-methylphenoxy)ethylthio]methyl]-1H-benzimidazole

C17H18N2OS (298.11397780000004)


   

N-(4-acetylphenyl)-5,6,7,8-tetrahydro-4H-cyclohepta[d]isoxazole-3-carboxamide

N-(4-acetylphenyl)-5,6,7,8-tetrahydro-4H-cyclohepta[d]isoxazole-3-carboxamide

C17H18N2O3 (298.1317358)


   

(2S)-2-[6-(4-chlorophenoxy)hexyl]-2-oxiranecarboxylic acid

(2S)-2-[6-(4-chlorophenoxy)hexyl]-2-oxiranecarboxylic acid

C15H19ClO4 (298.0971804)


   

3-[4-(2,4-Dimethyl-thiazol-5-YL)-pyrimidin-2-ylamino]-phenol

3-[4-(2,4-Dimethyl-thiazol-5-YL)-pyrimidin-2-ylamino]-phenol

C15H14N4OS (298.0888274)


   

3-Chloro-9-ethyl-6,7,8,9,10,11-hexahydro-7,11-methanocycloocta[B]quinolin-12-amine

3-Chloro-9-ethyl-6,7,8,9,10,11-hexahydro-7,11-methanocycloocta[B]quinolin-12-amine

C18H19ClN2 (298.1236684)


   

Cyclohexylmethyl 2-formylphenyl hydrogen phosphate

Cyclohexylmethyl 2-formylphenyl hydrogen phosphate

C14H19O5P (298.0970054)


   

2-((3-Tertbutyl-4-hydroxyphenyl)azo)benzoic acid

2-((3-Tertbutyl-4-hydroxyphenyl)azo)benzoic acid

C17H18N2O3 (298.1317358)


   

2-(2-Hydroxy-4-methoxyphenyl)-5-(3-hydroxypropyl)benzofuran

2-(2-Hydroxy-4-methoxyphenyl)-5-(3-hydroxypropyl)benzofuran

C18H18O4 (298.1205028)


A member of the class of benzofurans that is 1-benzofuran substituted by a 2-hydroxy-4-methoxyphenyl group at position 2 and a 3-hydroxypropyl group at position 5. It is a lignan derivative isolated from the roots of Krameria lappacea.

   

Chalcone, 2,4,4-trimethoxy-

Chalcone, 2,4,4-trimethoxy-

C18H18O4 (298.1205028)


   

5-(3-Hydroxypropyl)-2-(2-methoxy-4-hydroxyphenyl)benzofuran

5-(3-Hydroxypropyl)-2-(2-methoxy-4-hydroxyphenyl)benzofuran

C18H18O4 (298.1205028)


A member of the class of benzofurans that is 1-benzofuran substituted by a 3-hydroxypropyl group at position 5 and a 4-hydroxy-2-methoxyphenyl group at position 2. It is a lignan derivative isolated from the roots of Krameria lappacea.

   

4-(alpha-L-Rhamnopyranosyloxy)benzoic acid methyl ester

4-(alpha-L-Rhamnopyranosyloxy)benzoic acid methyl ester

C14H18O7 (298.10524780000003)


   
   
   

(2S,4R)-4-(hydroxymethyl)-6-(4-nitroanilino)cyclohexane-1,2,3-triol

(2S,4R)-4-(hydroxymethyl)-6-(4-nitroanilino)cyclohexane-1,2,3-triol

C13H18N2O6 (298.1164808)


   
   

(5E)-2-[(E)-pyrrol-2-ylidenemethyl]-5-[[(5E)-5-(1H-pyrrol-2-ylmethylidene)pyrrol-2-yl]methylidene]pyrrole

(5E)-2-[(E)-pyrrol-2-ylidenemethyl]-5-[[(5E)-5-(1H-pyrrol-2-ylmethylidene)pyrrol-2-yl]methylidene]pyrrole

C19H14N4 (298.1218404)


   

(2S)-5-hydroxy-7-methoxy-6,8-dimethylflavanone

(2S)-5-hydroxy-7-methoxy-6,8-dimethylflavanone

C18H18O4 (298.1205028)


A monohydroxyflavanone that is (2S)-flavanone substituted by a hydroxy group at position 5, a methoxy group at position 7 and methyl groups at positions 6 and 8. It has been isolated from the buds of Cleistocalyx operculatus.

   

3-[(Pyrazine-2-carbonyl)-hydrazono]-N-pyridin-2-yl-butyramide

3-[(Pyrazine-2-carbonyl)-hydrazono]-N-pyridin-2-yl-butyramide

C14H14N6O2 (298.1178184)


   

1-(1-azepanyl)-2-[(5-methyl-4-nitro-1H-pyrazol-3-yl)thio]ethanone

1-(1-azepanyl)-2-[(5-methyl-4-nitro-1H-pyrazol-3-yl)thio]ethanone

C12H18N4O3S (298.1099558)


   

2-[[5-[2-(1H-benzimidazol-2-yl)ethyl]-4-methyl-1,2,4-triazol-3-yl]thio]acetonitrile

2-[[5-[2-(1H-benzimidazol-2-yl)ethyl]-4-methyl-1,2,4-triazol-3-yl]thio]acetonitrile

C14H14N6S (298.1000604)


   

3-Phenyl-5-(2-phenylphenyl)-1,2,4-oxadiazole

3-Phenyl-5-(2-phenylphenyl)-1,2,4-oxadiazole

C20H14N2O (298.1106074)


   

6,7-Dimethoxy-3-phenyl-1H-quinazoline-2,4-dione

6,7-Dimethoxy-3-phenyl-1H-quinazoline-2,4-dione

C16H14N2O4 (298.0953524)


   

(2E)-N-(3-methoxyphenyl)-3-(4-nitrophenyl)prop-2-enamide

(2E)-N-(3-methoxyphenyl)-3-(4-nitrophenyl)prop-2-enamide

C16H14N2O4 (298.0953524)


   

N-(4-methoxyphenyl)-3,4-dihydro-1H-isoquinoline-2-carbothioamide

N-(4-methoxyphenyl)-3,4-dihydro-1H-isoquinoline-2-carbothioamide

C17H18N2OS (298.11397780000004)


   

N-[3-(1,3-benzodioxol-5-yl)-2-propen-1-ylidene]-5-methyl-1H-pyrazole-3-carbohydrazide

N-[3-(1,3-benzodioxol-5-yl)-2-propen-1-ylidene]-5-methyl-1H-pyrazole-3-carbohydrazide

C15H14N4O3 (298.1065854)


   

ethyl 3-(2-furoylamino)-1H-indole-2-carboxylate

ethyl 3-(2-furoylamino)-1H-indole-2-carboxylate

C16H14N2O4 (298.0953524)


   

N-[(4-phenoxybutanoyl)oxy]benzenecarboximidamide

N-[(4-phenoxybutanoyl)oxy]benzenecarboximidamide

C17H18N2O3 (298.1317358)


   

N-(3-methoxyphenyl)-4-(propanoylamino)benzamide

N-(3-methoxyphenyl)-4-(propanoylamino)benzamide

C17H18N2O3 (298.1317358)


   

N-[2-(3-methoxyanilino)-2-oxoethyl]-4-methylbenzamide

N-[2-(3-methoxyanilino)-2-oxoethyl]-4-methylbenzamide

C17H18N2O3 (298.1317358)


   

N-Tosyl-L-lysinyl methyl ketone

N-Tosyl-L-lysinyl methyl ketone

C14H22N2O3S (298.1351062)


   

1-Phenyl-3-(2-phenyldiazenylpropan-2-yl)thiourea

1-Phenyl-3-(2-phenyldiazenylpropan-2-yl)thiourea

C16H18N4S (298.12521080000005)


   

6-(4-Ethylphenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid

6-(4-Ethylphenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid

C14H18O7 (298.10524780000003)


   

3-O-(alpha-L-rhamnopyranosyl)-D-ribitol

3-O-(alpha-L-rhamnopyranosyl)-D-ribitol

C11H22O9 (298.1263762)


   

4-O-(alpha-L-rhamnopyranosyl)-D-ribitol

4-O-(alpha-L-rhamnopyranosyl)-D-ribitol

C11H22O9 (298.1263762)


   

2-[3-(2-Oxo-1-pyrrolidinyl)propyliminomethyl]indene-1,3-dione

2-[3-(2-Oxo-1-pyrrolidinyl)propyliminomethyl]indene-1,3-dione

C17H18N2O3 (298.1317358)


   

1-(3,4-Dimethoxyphenyl)-3-[(5-methyl-2-pyridinyl)imino]-1-propanone

1-(3,4-Dimethoxyphenyl)-3-[(5-methyl-2-pyridinyl)imino]-1-propanone

C17H18N2O3 (298.1317358)


   

6-(3-Ethylphenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid

6-(3-Ethylphenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid

C14H18O7 (298.10524780000003)


   

(2R,3R,4R)-2,3,5-trihydroxy-4-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxypentanoic acid

(2R,3R,4R)-2,3,5-trihydroxy-4-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxypentanoic acid

C10H18O10 (298.0899928)


   
   

5,7-Dimethyl-4-hydroxy-3-methoxyflavanone

5,7-Dimethyl-4-hydroxy-3-methoxyflavanone

C18H18O4 (298.1205028)


   

1-(2-Hydroxy-6-methoxyphenyl)-5-phenyl-1,3-pentanedione

1-(2-Hydroxy-6-methoxyphenyl)-5-phenyl-1,3-pentanedione

C18H18O4 (298.1205028)


   

1-(2-Hydroxy-5-methoxyphenyl)-5-phenyl-1,3-pentanedione

1-(2-Hydroxy-5-methoxyphenyl)-5-phenyl-1,3-pentanedione

C18H18O4 (298.1205028)


   

4-Acethoxy-7-methoxyflavan

4-Acethoxy-7-methoxyflavan

C18H18O4 (298.1205028)


   

4-Phenylazobenzoic acid trimethylsilyl ester

4-Phenylazobenzoic acid trimethylsilyl ester

C16H18N2O2Si (298.1137488)


   

2-[3-(4-Methoxybenzoyl)phenyl]propionic acid methyl ester

2-[3-(4-Methoxybenzoyl)phenyl]propionic acid methyl ester

C18H18O4 (298.1205028)


   

2-[3-(3-Methoxybenzoyl)phenyl]propionic acid methyl ester

2-[3-(3-Methoxybenzoyl)phenyl]propionic acid methyl ester

C18H18O4 (298.1205028)


   

DIBENZYL SUCCINATE

DIBENZYL SUCCINATE

C18H18O4 (298.1205028)


   

Dimethylaminopropionylphenothiazine

Dimethylaminopropionylphenothiazine

C17H18N2OS (298.11397780000004)


A - Alimentary tract and metabolism > A03 - Drugs for functional gastrointestinal disorders > A03A - Drugs for functional gastrointestinal disorders > A03AC - Synthetic antispasmodics, amides with tertiary amines

   

PS-5

3-(2-Acetamidoethyl)thio-6-ethyl-7-oxo-1-azabicyclo(3.2.0)hept-2-ene-2-carboxylic acid

C13H18N2O4S (298.0987228)


D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D013845 - Thienamycins D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D047090 - beta-Lactams D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D007769 - Lactams

   

1-[(2R,5S,9R)-9-Bromo-6,10,10-trimethylspiro[4.5]dec-6-en-2-yl]ethan-1-one

1-[(2R,5S,9R)-9-Bromo-6,10,10-trimethylspiro[4.5]dec-6-en-2-yl]ethan-1-one

C15H23BrO (298.0932168)


   

N-Desmethylolanzapine

2-Methyl-4-(1-piperazinyl)-10H-thienol[2,3-b][1,5]benzodiazepine

C16H18N4S (298.12521080000005)


   

2-methyl-3-[(2E)-5-carboxy-3-methylpent-2-enyl]-1,4-naphthoquinone

2-methyl-3-[(2E)-5-carboxy-3-methylpent-2-enyl]-1,4-naphthoquinone

C18H18O4 (298.1205028)


A member of the class of naphthoquinones that is 2-methyl-1,4-naphthoquinone which is substituted at position 3 by a (2E)-5-carboxy-3-methylpent-2-en-1-yl group. A urinary metabolite of vitamin K1.

   

7-Hydroxy-5-methoxy-6,8-dimethylflavanone

7-Hydroxy-5-methoxy-6,8-dimethylflavanone

C18H18O4 (298.1205028)


   

5,7-Dimethoxy-6-methylflavanone

5,7-Dimethoxy-6-methylflavanone

C18H18O4 (298.1205028)


   

p-Ts-L-Lys-Me

p-Ts-L-Lys-Me

C14H22N2O3S (298.1351062)


A methyl ketone that is L-lysine with an alpha-amine hydrogen substituted with a 4-methylbenzenesulfonamide (tosyl) group and a methyl group replacing the hydroxy of the carboxylic acid.

   

(2r)-5-hydroxy-6,8,8-trimethyl-2-phenyl-2,3-dihydro-1-benzopyran-4,7-dione

(2r)-5-hydroxy-6,8,8-trimethyl-2-phenyl-2,3-dihydro-1-benzopyran-4,7-dione

C18H18O4 (298.1205028)


   

1-(2-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)ethanone

1-(2-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)ethanone

C14H18O7 (298.10524780000003)


   

(2r,3s,4s,4ar,6s,7r,8r,8as)-2,6-bis(hydroxymethyl)-hexahydropyrano[3,2-b]pyran-3,4,4a,7,8,8a-hexol

(2r,3s,4s,4ar,6s,7r,8r,8as)-2,6-bis(hydroxymethyl)-hexahydropyrano[3,2-b]pyran-3,4,4a,7,8,8a-hexol

C10H18O10 (298.0899928)


   

{9-methoxy-4,5-dimethylnaphtho[2,3-b]furan-3-yl}methyl acetate

{9-methoxy-4,5-dimethylnaphtho[2,3-b]furan-3-yl}methyl acetate

C18H18O4 (298.1205028)


   

1,6-dimethyl 5,10-dihydrophenazine-1,6-dicarboxylate

1,6-dimethyl 5,10-dihydrophenazine-1,6-dicarboxylate

C16H14N2O4 (298.0953524)


   

4-[(1s,3ar,4s,6ar)-4-(4-hydroxyphenyl)-hexahydrofuro[3,4-c]furan-1-yl]phenol

4-[(1s,3ar,4s,6ar)-4-(4-hydroxyphenyl)-hexahydrofuro[3,4-c]furan-1-yl]phenol

C18H18O4 (298.1205028)


   

7-isopropyl-3,3,4-trimethylnaphtho[2,3-b]furan-2,5,6-trione

7-isopropyl-3,3,4-trimethylnaphtho[2,3-b]furan-2,5,6-trione

C18H18O4 (298.1205028)


   

1-(ethylsulfanyl)-1-{[1-(ethylsulfanyl)butyl]disulfanyl}butane

1-(ethylsulfanyl)-1-{[1-(ethylsulfanyl)butyl]disulfanyl}butane

C12H26S4 (298.0917276)


   

methyl 2-(n-hydroxyimino)-3-[7-(3-methylbuta-1,3-dien-1-yl)-1h-indol-3-yl]propanoate

methyl 2-(n-hydroxyimino)-3-[7-(3-methylbuta-1,3-dien-1-yl)-1h-indol-3-yl]propanoate

C17H18N2O3 (298.1317358)


   

(2s)-5-hydroxy-7-methoxy-6,8-dimethyl-2-phenyl-2,3-dihydro-1-benzopyran-4-one

(2s)-5-hydroxy-7-methoxy-6,8-dimethyl-2-phenyl-2,3-dihydro-1-benzopyran-4-one

C18H18O4 (298.1205028)


   

2-bromo-1,1,9-trimethyl-5-methylidenespiro[5.5]undec-8-en-3-ol

2-bromo-1,1,9-trimethyl-5-methylidenespiro[5.5]undec-8-en-3-ol

C15H23BrO (298.0932168)


   

(2s,6s,8s)-8-bromo-3,7,7-trimethyl-11-methylidenespiro[5.5]undec-3-en-2-ol

(2s,6s,8s)-8-bromo-3,7,7-trimethyl-11-methylidenespiro[5.5]undec-3-en-2-ol

C15H23BrO (298.0932168)


   

2-(hydroxymethyl)-5-methoxy-7-(3-methyl-2-oxobut-3-en-1-yl)naphthalene-1-carbaldehyde

2-(hydroxymethyl)-5-methoxy-7-(3-methyl-2-oxobut-3-en-1-yl)naphthalene-1-carbaldehyde

C18H18O4 (298.1205028)


   

2-hydroxy-4,4,14-trimethyl-12-oxatetracyclo[8.6.0.0³,⁸.0¹¹,¹⁵]hexadeca-1,3(8),6,9-tetraene-5,13-dione

2-hydroxy-4,4,14-trimethyl-12-oxatetracyclo[8.6.0.0³,⁸.0¹¹,¹⁵]hexadeca-1,3(8),6,9-tetraene-5,13-dione

C18H18O4 (298.1205028)


   

[(2s,3r,4r,5s,6s)-3,4,5-trihydroxy-6-methoxyoxan-2-yl]methyl benzoate

[(2s,3r,4r,5s,6s)-3,4,5-trihydroxy-6-methoxyoxan-2-yl]methyl benzoate

C14H18O7 (298.10524780000003)


   

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

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

C18H18O4 (298.1205028)


   

(4s)-3,4-bis[(3-hydroxyphenyl)methyl]oxolan-2-one

(4s)-3,4-bis[(3-hydroxyphenyl)methyl]oxolan-2-one

C18H18O4 (298.1205028)


   

(2s,3r,6s)-2-bromo-1,1,9-trimethyl-5-methylidenespiro[5.5]undec-8-en-3-ol

(2s,3r,6s)-2-bromo-1,1,9-trimethyl-5-methylidenespiro[5.5]undec-8-en-3-ol

C15H23BrO (298.0932168)


   

(1s,5s,6r,8r,9s)-9-bromo-2,5,6,8-tetramethyl-7-oxatricyclo[6.2.2.0¹,⁶]dodec-2-ene

(1s,5s,6r,8r,9s)-9-bromo-2,5,6,8-tetramethyl-7-oxatricyclo[6.2.2.0¹,⁶]dodec-2-ene

C15H23BrO (298.0932168)


   

(2s,3r)-5-[2-hydroxy-5-(prop-2-en-1-yl)phenyl]-2-(hydroxymethyl)-2,3-dihydro-1-benzofuran-3-ol

(2s,3r)-5-[2-hydroxy-5-(prop-2-en-1-yl)phenyl]-2-(hydroxymethyl)-2,3-dihydro-1-benzofuran-3-ol

C18H18O4 (298.1205028)


   

n-(6-chloro-7-hydroxy-5,7a-dimethyl-1-oxo-6,7-dihydro-5h-pyrrolizin-3-yl)-3-methylbut-2-enamide

n-(6-chloro-7-hydroxy-5,7a-dimethyl-1-oxo-6,7-dihydro-5h-pyrrolizin-3-yl)-3-methylbut-2-enamide

C14H19ClN2O3 (298.1084134)


   

(11r,14r,15s)-2-hydroxy-4,4,14-trimethyl-12-oxatetracyclo[8.6.0.0³,⁸.0¹¹,¹⁵]hexadeca-1,3(8),6,9-tetraene-5,13-dione

(11r,14r,15s)-2-hydroxy-4,4,14-trimethyl-12-oxatetracyclo[8.6.0.0³,⁸.0¹¹,¹⁵]hexadeca-1,3(8),6,9-tetraene-5,13-dione

C18H18O4 (298.1205028)


   

2,3,5,7-tetramethoxyphenanthrene

2,3,5,7-tetramethoxyphenanthrene

C18H18O4 (298.1205028)


   

(2r,3r,6r)-2-bromo-1,1,9-trimethyl-5-methylidenespiro[5.5]undec-8-en-3-ol

(2r,3r,6r)-2-bromo-1,1,9-trimethyl-5-methylidenespiro[5.5]undec-8-en-3-ol

C15H23BrO (298.0932168)


   

{4,5-dimethoxy-7-methyl-2-oxo-5h,7h,8h-pyrano[3,2-c]pyran-3-yl}methyl acetate

{4,5-dimethoxy-7-methyl-2-oxo-5h,7h,8h-pyrano[3,2-c]pyran-3-yl}methyl acetate

C14H18O7 (298.10524780000003)


   

(3e)-1-bromo-5-(2,2-dimethyl-6-methylidenecyclohex-3-en-1-yl)-3-methylpent-3-en-2-ol

(3e)-1-bromo-5-(2,2-dimethyl-6-methylidenecyclohex-3-en-1-yl)-3-methylpent-3-en-2-ol

C15H23BrO (298.0932168)


   

(1r,3s,5'r,6s)-5'-bromo-2',6,6',6'-tetramethyl-7-oxaspiro[bicyclo[4.1.0]heptane-3,1'-cyclohexan]-2'-ene

(1r,3s,5'r,6s)-5'-bromo-2',6,6',6'-tetramethyl-7-oxaspiro[bicyclo[4.1.0]heptane-3,1'-cyclohexan]-2'-ene

C15H23BrO (298.0932168)


   

1,2,6,7-tetrahydro-4,8-dimethylphenanthro[3,4-b]furan-1,2,9-triol

NA

C18H18O4 (298.1205028)


{"Ingredient_id": "HBIN000679","Ingredient_name": "1,2,6,7-tetrahydro-4,8-dimethylphenanthro[3,4-b]furan-1,2,9-triol","Alias": "NA","Ingredient_formula": "C18H18O4","Ingredient_Smile": "NA","Ingredient_weight": "298.338","OB_score": "NA","CAS_id": "199597-55-2","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "9602","PubChem_id": "NA","DrugBank_id": "NA"}

   

1-methylxanthosine

NA

C11H14N4O6 (298.0913304)


{"Ingredient_id": "HBIN002817","Ingredient_name": "1-methylxanthosine","Alias": "NA","Ingredient_formula": "C11H14N4O6","Ingredient_Smile": "CN1C(=O)C2=C(NC1=O)N(C=N2)C3C(C(C(O3)CO)O)O","Ingredient_weight": "298.25 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "14808","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "5319815","DrugBank_id": "NA"}

   

2-c-methyl-d-erythritol 1-o-β-d-fructofuranoside

NA

C11H22O9 (298.1263762)


{"Ingredient_id": "HBIN005466","Ingredient_name": "2-c-methyl-d-erythritol 1-o-\u03b2-d-fructofuranoside","Alias": "NA","Ingredient_formula": "C11H22O9","Ingredient_Smile": "CC(COC1(C(C(C(O1)CO)O)O)CO)(C(CO)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "14413","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   

2-c-methyl-d-erythritol 1-o-β-d-glucopyranoside

NA

C11H22O9 (298.1263762)


{"Ingredient_id": "HBIN005467","Ingredient_name": "2-c-methyl-d-erythritol 1-o-\u03b2-d-glucopyranoside","Alias": "NA","Ingredient_formula": "C11H22O9","Ingredient_Smile": "CC(COC1(C(C(C(O1)CO)O)O)CO)(C(CO)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "14416","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   

2-c-methyl-d-erythritol 3-o-β-d-fructofuranoside

NA

C11H22O9 (298.1263762)


{"Ingredient_id": "HBIN005468","Ingredient_name": "2-c-methyl-d-erythritol 3-o-\u03b2-d-fructofuranoside","Alias": "NA","Ingredient_formula": "C11H22O9","Ingredient_Smile": "CC(CO)(C(CO)OC1(C(C(C(O1)CO)O)O)CO)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "14414","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   

2-c-methyl-d-erythritol 3-o-β-d-glucopyranoside

NA

C11H22O9 (298.1263762)


{"Ingredient_id": "HBIN005469","Ingredient_name": "2-c-methyl-d-erythritol 3-o-\u03b2-d-glucopyranoside","Alias": "NA","Ingredient_formula": "C11H22O9","Ingredient_Smile": "CC(CO)(C(CO)OC1(C(C(C(O1)CO)O)O)CO)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "14417","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   

2-c-methyl-d-erythritol 4-o-β-d-fructofuranoside

NA

C11H22O9 (298.1263762)


{"Ingredient_id": "HBIN005470","Ingredient_name": "2-c-methyl-d-erythritol 4-o-\u03b2-d-fructofuranoside","Alias": "NA","Ingredient_formula": "C11H22O9","Ingredient_Smile": "CC(CO)(C(COC1(C(C(C(O1)CO)O)O)CO)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "14415","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   

2-c-methyl-d-erythritol 4-o-β-d-glucopyranoside

NA

C11H22O9 (298.1263762)


{"Ingredient_id": "HBIN005471","Ingredient_name": "2-c-methyl-d-erythritol 4-o-\u03b2-d-glucopyranoside","Alias": "NA","Ingredient_formula": "C11H22O9","Ingredient_Smile": "CC(CO)(C(COC1(C(C(C(O1)CO)O)O)CO)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "14418","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   

4-[(2s,3r)-3-methyl-7-((e)-1-propenyl)-2,3-di-hydro-1,4-benzodioxin-2-yl]-1,3-benzenediol

NA

C18H18O4 (298.1205028)


{"Ingredient_id": "HBIN009890","Ingredient_name": "4-[(2s,3r)-3-methyl-7-((e)-1-propenyl)-2,3-di-hydro-1,4-benzodioxin-2-yl]-1,3-benzenediol","Alias": "NA","Ingredient_formula": "C18H18O4","Ingredient_Smile": "CC=CC1=CC2=C(C=C1)OC(C(O2)C3=C(C=C(C=C3)O)O)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "14680","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   

4-[(2s,3s)-3-methyl-7-((e)-1-propenyl)-2,3-di-hydro-1,4-benzodioxin-2-yl]-1,3-benzenediol

NA

C18H18O4 (298.1205028)


{"Ingredient_id": "HBIN009893","Ingredient_name": "4-[(2s,3s)-3-methyl-7-((e)-1-propenyl)-2,3-di-hydro-1,4-benzodioxin-2-yl]-1,3-benzenediol","Alias": "NA","Ingredient_formula": "C18H18O4","Ingredient_Smile": "CC=CC1=CC2=C(C=C1)OC(C(O2)C3=C(C=C(C=C3)O)O)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "14681","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   

4',6'-dihydroxy-3',5'-dimethyl-2'-methoxychal-cone

NA

C18H18O4 (298.1205028)


{"Ingredient_id": "HBIN010073","Ingredient_name": "4',6'-dihydroxy-3',5'-dimethyl-2'-methoxychal-cone","Alias": "NA","Ingredient_formula": "C18H18O4","Ingredient_Smile": "CC1=C(C(=C(C(=C1O)C(=O)C=CC2=CC=CC=C2)OC)C)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "5856","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   

(6r,9r,10s)-10-bromo-9-hydroxy-chamigra-2,7(14)-diene

NA

C15H23BrO (298.0932168)


{"Ingredient_id": "HBIN012785","Ingredient_name": "(6r,9r,10s)-10-bromo-9-hydroxy-chamigra-2,7(14)-diene","Alias": "NA","Ingredient_formula": "C15H23BrO","Ingredient_Smile": "CC1=CCC2(CC1)C(=C)CC(C(C2(C)C)Br)O","Ingredient_weight": "299.25 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "2624","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "12016530","DrugBank_id": "NA"}

   

bilatriene

NA

C19H14N4 (298.1218404)


{"Ingredient_id": "HBIN018506","Ingredient_name": "bilatriene","Alias": "NA","Ingredient_formula": "C19H14N4","Ingredient_Smile": "C1=CC(=CC2=NC(=CC3=CC=C(N3)C=C4C=CC=N4)C=C2)N=C1","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "2373","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   

(2r,3r,4r,4ar)-3-bromo-1,4,4a,7-tetramethyl-2,3,4,5,8,9-hexahydrobenzo[7]annulen-2-ol

(2r,3r,4r,4ar)-3-bromo-1,4,4a,7-tetramethyl-2,3,4,5,8,9-hexahydrobenzo[7]annulen-2-ol

C15H23BrO (298.0932168)


   

2-[5-(3-hydroxypropyl)-1-benzofuran-2-yl]-5-methoxyphenol

2-[5-(3-hydroxypropyl)-1-benzofuran-2-yl]-5-methoxyphenol

C18H18O4 (298.1205028)


   

4-bromo-1-isopropyl-3,6-dimethyl-1h,1ah,2h,3h,4h,5h,6bh-cyclopropa[e]inden-3a-ol

4-bromo-1-isopropyl-3,6-dimethyl-1h,1ah,2h,3h,4h,5h,6bh-cyclopropa[e]inden-3a-ol

C15H23BrO (298.0932168)


   

1-(2-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)ethanone

1-(2-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)ethanone

C14H18O7 (298.10524780000003)


   

2-(methylsulfanyl)-1-{[2-(methylsulfanyl)pentyl]disulfanyl}pentane

2-(methylsulfanyl)-1-{[2-(methylsulfanyl)pentyl]disulfanyl}pentane

C12H26S4 (298.0917276)


   

(1r,3s,4r,5s)-1-[2-(1,3-oxazol-5-ylmethyl)-1,3-oxazol-4-yl]hexane-1,3,4,5-tetrol

(1r,3s,4r,5s)-1-[2-(1,3-oxazol-5-ylmethyl)-1,3-oxazol-4-yl]hexane-1,3,4,5-tetrol

C13H18N2O6 (298.1164808)


   

(2r,3s,6r)-2-bromo-1,1,9-trimethyl-5-methylidenespiro[5.5]undec-8-en-3-ol

(2r,3s,6r)-2-bromo-1,1,9-trimethyl-5-methylidenespiro[5.5]undec-8-en-3-ol

C15H23BrO (298.0932168)


   

(2s,3z)-1-bromo-5-[(1s)-2,2-dimethyl-6-methylidenecyclohex-3-en-1-yl]-3-methylpent-3-en-2-ol

(2s,3z)-1-bromo-5-[(1s)-2,2-dimethyl-6-methylidenecyclohex-3-en-1-yl]-3-methylpent-3-en-2-ol

C15H23BrO (298.0932168)


   

2-(3-hydroxy-5-methoxy-2,4-dimethylphenyl)-5-methyl-1-benzofuran-4-ol

2-(3-hydroxy-5-methoxy-2,4-dimethylphenyl)-5-methyl-1-benzofuran-4-ol

C18H18O4 (298.1205028)


   

3-[2-(1h-indol-3-yl)-3h-imidazol-4-yl]-1h-indole

3-[2-(1h-indol-3-yl)-3h-imidazol-4-yl]-1h-indole

C19H14N4 (298.1218404)


   

18-hydroxy-2,7,11,13-tetraazapentacyclo[12.3.1.0⁴,¹⁷.0⁷,¹⁶.0¹⁰,¹⁵]octadeca-1(18),2,4(17),13,15-pentaene-6-carboxylic acid

18-hydroxy-2,7,11,13-tetraazapentacyclo[12.3.1.0⁴,¹⁷.0⁷,¹⁶.0¹⁰,¹⁵]octadeca-1(18),2,4(17),13,15-pentaene-6-carboxylic acid

C15H14N4O3 (298.1065854)


   

(4s,5r,7e)-7-(hexa-2,4-diyn-1-ylidene)-1,6-dioxaspiro[4.4]nona-2,8-dien-4-yl 3-methylbutanoate

(4s,5r,7e)-7-(hexa-2,4-diyn-1-ylidene)-1,6-dioxaspiro[4.4]nona-2,8-dien-4-yl 3-methylbutanoate

C18H18O4 (298.1205028)


   

(3s,4e,6e)-1-(acetyloxy)tetradeca-4,6-dien-8,10,12-triyn-3-yl acetate

(3s,4e,6e)-1-(acetyloxy)tetradeca-4,6-dien-8,10,12-triyn-3-yl acetate

C18H18O4 (298.1205028)


   

(3,4,5-trihydroxy-6-methoxyoxan-2-yl)methyl benzoate

(3,4,5-trihydroxy-6-methoxyoxan-2-yl)methyl benzoate

C14H18O7 (298.10524780000003)


   
   

(2r,3s,6s)-2-bromo-1,1,9-trimethyl-5-methylidenespiro[5.5]undec-8-en-3-ol

(2r,3s,6s)-2-bromo-1,1,9-trimethyl-5-methylidenespiro[5.5]undec-8-en-3-ol

C15H23BrO (298.0932168)


   

(4r,4ar,7r,7as,8as)-7-(chloromethyl)-4,8a-dihydroxy-3,5,7a-trimethyl-4h,4ah,7h,8h-indeno[5,6-b]furan-2-one

(4r,4ar,7r,7as,8as)-7-(chloromethyl)-4,8a-dihydroxy-3,5,7a-trimethyl-4h,4ah,7h,8h-indeno[5,6-b]furan-2-one

C15H19ClO4 (298.0971804)


   

(1s,3ar,4r,7ar)-1-(acetyloxy)-4,7a-dimethyl-3,7-dioxo-tetrahydro-2-benzofuran-3a-yl acetate

(1s,3ar,4r,7ar)-1-(acetyloxy)-4,7a-dimethyl-3,7-dioxo-tetrahydro-2-benzofuran-3a-yl acetate

C14H18O7 (298.10524780000003)


   

5,7,8-trimethoxy-2-phenyl-2h-chromene

5,7,8-trimethoxy-2-phenyl-2h-chromene

C18H18O4 (298.1205028)


   

2-phenylethyl 3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate

2-phenylethyl 3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate

C18H18O4 (298.1205028)


   

(1s,1as,3r,3ar,4s,6bs)-4-bromo-1-isopropyl-3,6-dimethyl-1h,1ah,2h,3h,4h,5h,6bh-cyclopropa[e]inden-3a-ol

(1s,1as,3r,3ar,4s,6bs)-4-bromo-1-isopropyl-3,6-dimethyl-1h,1ah,2h,3h,4h,5h,6bh-cyclopropa[e]inden-3a-ol

C15H23BrO (298.0932168)


   

1-{2,4-dihydroxy-6-[2-(4-hydroxyphenyl)ethenyl]phenyl}-2-methylpropan-1-one

1-{2,4-dihydroxy-6-[2-(4-hydroxyphenyl)ethenyl]phenyl}-2-methylpropan-1-one

C18H18O4 (298.1205028)


   

3-(3,4-dimethoxyphenyl)prop-2-en-1-yl benzoate

3-(3,4-dimethoxyphenyl)prop-2-en-1-yl benzoate

C18H18O4 (298.1205028)


   

2-benzoyl-4-(3-methylbut-2-en-1-yl)benzene-1,3,5-triol

2-benzoyl-4-(3-methylbut-2-en-1-yl)benzene-1,3,5-triol

C18H18O4 (298.1205028)


   

4-bromo-1,5,5,9-tetramethylspiro[5.5]undeca-1,8-dien-3-ol

4-bromo-1,5,5,9-tetramethylspiro[5.5]undeca-1,8-dien-3-ol

C15H23BrO (298.0932168)


   

4-[(2s,5s)-5-(4-hydroxyphenyl)-3,4-dimethyl-2,5-dihydrofuran-2-yl]benzene-1,2-diol

4-[(2s,5s)-5-(4-hydroxyphenyl)-3,4-dimethyl-2,5-dihydrofuran-2-yl]benzene-1,2-diol

C18H18O4 (298.1205028)


   

methyl (2r,4s)-4-(3-acetyl-2,6-dihydroxyphenyl)-2-hydroxy-4-methoxybutanoate

methyl (2r,4s)-4-(3-acetyl-2,6-dihydroxyphenyl)-2-hydroxy-4-methoxybutanoate

C14H18O7 (298.10524780000003)


   

(1s,3ar,4s,7ar)-1-(acetyloxy)-4,7a-dimethyl-3,7-dioxo-tetrahydro-2-benzofuran-3a-yl acetate

(1s,3ar,4s,7ar)-1-(acetyloxy)-4,7a-dimethyl-3,7-dioxo-tetrahydro-2-benzofuran-3a-yl acetate

C14H18O7 (298.10524780000003)


   

3-bromo-1,4,4a,7-tetramethyl-2,3,4,5,8,9-hexahydrobenzo[7]annulen-2-ol

3-bromo-1,4,4a,7-tetramethyl-2,3,4,5,8,9-hexahydrobenzo[7]annulen-2-ol

C15H23BrO (298.0932168)


   

4-(3-acetyl-2,6-dihydroxy-5-methylphenyl)-4-hydroxy-2-methoxybutanoic acid

4-(3-acetyl-2,6-dihydroxy-5-methylphenyl)-4-hydroxy-2-methoxybutanoic acid

C14H18O7 (298.10524780000003)


   

4-hydroxy-6,6,8-trimethyl-2-phenyl-2,3-dihydro-1-benzopyran-5,7-dione

4-hydroxy-6,6,8-trimethyl-2-phenyl-2,3-dihydro-1-benzopyran-5,7-dione

C18H18O4 (298.1205028)


   

methyl 2-[(6z)-6-[(2e)-1-hydroxy-3-phenylprop-2-en-1-ylidene]-5-oxocyclohex-3-en-1-yl]acetate

methyl 2-[(6z)-6-[(2e)-1-hydroxy-3-phenylprop-2-en-1-ylidene]-5-oxocyclohex-3-en-1-yl]acetate

C18H18O4 (298.1205028)


   

2,2,4-trimethyl-6-[(2e)-3-phenylprop-2-enoyl]cyclohexane-1,3,5-trione

2,2,4-trimethyl-6-[(2e)-3-phenylprop-2-enoyl]cyclohexane-1,3,5-trione

C18H18O4 (298.1205028)


   

1-(acetyloxy)-4,7a-dimethyl-3,7-dioxo-tetrahydro-2-benzofuran-3a-yl acetate

1-(acetyloxy)-4,7a-dimethyl-3,7-dioxo-tetrahydro-2-benzofuran-3a-yl acetate

C14H18O7 (298.10524780000003)


   

(4r,4ar,7r,7ar,8as)-7-(chloromethyl)-4,8a-dihydroxy-3,5,7a-trimethyl-4h,4ah,7h,8h-indeno[5,6-b]furan-2-one

(4r,4ar,7r,7ar,8as)-7-(chloromethyl)-4,8a-dihydroxy-3,5,7a-trimethyl-4h,4ah,7h,8h-indeno[5,6-b]furan-2-one

C15H19ClO4 (298.0971804)


   

1-phenyl-2-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}ethanone

1-phenyl-2-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}ethanone

C14H18O7 (298.10524780000003)


   

1-phenyl-3-(2,3,4-trimethoxyphenyl)prop-2-en-1-one

1-phenyl-3-(2,3,4-trimethoxyphenyl)prop-2-en-1-one

C18H18O4 (298.1205028)


   

4-[(1r,3as,4r,6as)-4-(4-hydroxyphenyl)-hexahydrofuro[3,4-c]furan-1-yl]phenol

4-[(1r,3as,4r,6as)-4-(4-hydroxyphenyl)-hexahydrofuro[3,4-c]furan-1-yl]phenol

C18H18O4 (298.1205028)


   

(2s)-7-hydroxy-5-methoxy-6,8-dimethyl-2-phenyl-2,3-dihydro-1-benzopyran-4-one

(2s)-7-hydroxy-5-methoxy-6,8-dimethyl-2-phenyl-2,3-dihydro-1-benzopyran-4-one

C18H18O4 (298.1205028)


   

3-[2,4-dihydroxy-6-(2-hydroxypropyl)benzoyloxy]butanoic acid

3-[2,4-dihydroxy-6-(2-hydroxypropyl)benzoyloxy]butanoic acid

C14H18O7 (298.10524780000003)


   

(2e)-3-phenyl-1-(2,4,6-trimethoxyphenyl)prop-2-en-1-one

(2e)-3-phenyl-1-(2,4,6-trimethoxyphenyl)prop-2-en-1-one

C18H18O4 (298.1205028)


   

(3s,3ar,6ar,8s,9ar,9br)-3-(chloromethyl)-3,8-dihydroxy-6,9-dimethylidene-octahydroazuleno[4,5-b]furan-2-one

(3s,3ar,6ar,8s,9ar,9br)-3-(chloromethyl)-3,8-dihydroxy-6,9-dimethylidene-octahydroazuleno[4,5-b]furan-2-one

C15H19ClO4 (298.0971804)


   

n-[(5s,6s,7s,7as)-6-chloro-7-hydroxy-5,7a-dimethyl-1-oxo-6,7-dihydro-5h-pyrrolizin-3-yl]-3-methylbut-2-enamide

n-[(5s,6s,7s,7as)-6-chloro-7-hydroxy-5,7a-dimethyl-1-oxo-6,7-dihydro-5h-pyrrolizin-3-yl]-3-methylbut-2-enamide

C14H19ClN2O3 (298.1084134)


   

(2e)-1-(4-hydroxy-3,6-dimethoxy-2-methylphenyl)-3-phenylprop-2-en-1-one

(2e)-1-(4-hydroxy-3,6-dimethoxy-2-methylphenyl)-3-phenylprop-2-en-1-one

C18H18O4 (298.1205028)


   

(1,4,10-trimethoxyanthracen-2-yl)methanol

(1,4,10-trimethoxyanthracen-2-yl)methanol

C18H18O4 (298.1205028)


   

5'-bromo-2',6,6',6'-tetramethyl-7-oxaspiro[bicyclo[4.1.0]heptane-3,1'-cyclohexan]-2'-ene

5'-bromo-2',6,6',6'-tetramethyl-7-oxaspiro[bicyclo[4.1.0]heptane-3,1'-cyclohexan]-2'-ene

C15H23BrO (298.0932168)


   

methyl 2,3-dimethoxyphenazine-1-carboxylate

methyl 2,3-dimethoxyphenazine-1-carboxylate

C16H14N2O4 (298.0953524)


   

(6s,10s)-18-hydroxy-2,7,11,13-tetraazapentacyclo[12.3.1.0⁴,¹⁷.0⁷,¹⁶.0¹⁰,¹⁵]octadeca-1(18),2,4(17),13,15-pentaene-6-carboxylic acid

(6s,10s)-18-hydroxy-2,7,11,13-tetraazapentacyclo[12.3.1.0⁴,¹⁷.0⁷,¹⁶.0¹⁰,¹⁵]octadeca-1(18),2,4(17),13,15-pentaene-6-carboxylic acid

C15H14N4O3 (298.1065854)


   

3-[3-(methoxycarbonyl)-9h-pyrido[3,4-b]indol-1-yl]propanoic acid

3-[3-(methoxycarbonyl)-9h-pyrido[3,4-b]indol-1-yl]propanoic acid

C16H14N2O4 (298.0953524)


   

(3s,6s,10r)-10-bromo-3,7,11,11-tetramethylspiro[5.5]undec-7-en-2-one

(3s,6s,10r)-10-bromo-3,7,11,11-tetramethylspiro[5.5]undec-7-en-2-one

C15H23BrO (298.0932168)


   

5-hydroxy-6,8,8-trimethyl-2-phenyl-2,3-dihydro-1-benzopyran-4,7-dione

5-hydroxy-6,8,8-trimethyl-2-phenyl-2,3-dihydro-1-benzopyran-4,7-dione

C18H18O4 (298.1205028)


   

8,9-dihydroxy-3-methoxy-2,2,6-trimethylanthracen-1-one

8,9-dihydroxy-3-methoxy-2,2,6-trimethylanthracen-1-one

C18H18O4 (298.1205028)


   

4-[5-(4-hydroxyphenyl)-3,4-dimethyl-2,5-dihydrofuran-2-yl]benzene-1,2-diol

4-[5-(4-hydroxyphenyl)-3,4-dimethyl-2,5-dihydrofuran-2-yl]benzene-1,2-diol

C18H18O4 (298.1205028)


   

7-(hexa-2,4-diyn-1-ylidene)-1,6-dioxaspiro[4.4]nona-2,8-dien-4-yl 3-methylbutanoate

7-(hexa-2,4-diyn-1-ylidene)-1,6-dioxaspiro[4.4]nona-2,8-dien-4-yl 3-methylbutanoate

C18H18O4 (298.1205028)


   

(2r,3'r,7r,8r,8ar)-5-chloro-7-hydroxy-3'-(hydroxymethyl)-3',8,8a-trimethyl-7,8-dihydro-1h-spiro[naphthalene-2,2'-oxiran]-3-one

(2r,3'r,7r,8r,8ar)-5-chloro-7-hydroxy-3'-(hydroxymethyl)-3',8,8a-trimethyl-7,8-dihydro-1h-spiro[naphthalene-2,2'-oxiran]-3-one

C15H19ClO4 (298.0971804)


   

5-[2-hydroxy-5-(prop-2-en-1-yl)phenyl]-2-(hydroxymethyl)-2,3-dihydro-1-benzofuran-3-ol

5-[2-hydroxy-5-(prop-2-en-1-yl)phenyl]-2-(hydroxymethyl)-2,3-dihydro-1-benzofuran-3-ol

C18H18O4 (298.1205028)


   

(2z)-2-[(2e)-1-hydroxy-3-phenylprop-2-en-1-ylidene]-5-methoxy-6,6-dimethylcyclohex-4-ene-1,3-dione

(2z)-2-[(2e)-1-hydroxy-3-phenylprop-2-en-1-ylidene]-5-methoxy-6,6-dimethylcyclohex-4-ene-1,3-dione

C18H18O4 (298.1205028)


   

(3s,4s,6s)-4-bromo-1,5,5,9-tetramethylspiro[5.5]undeca-1,8-dien-3-ol

(3s,4s,6s)-4-bromo-1,5,5,9-tetramethylspiro[5.5]undeca-1,8-dien-3-ol

C15H23BrO (298.0932168)


   

methyl 2-[(5-benzoylpyridin-2-yl)formamido]acetate

methyl 2-[(5-benzoylpyridin-2-yl)formamido]acetate

C16H14N2O4 (298.0953524)


   

(1s,2s)-4,8-dimethyl-1h,2h,6h,7h-phenanthro[3,4-b]furan-1,2,9-triol

(1s,2s)-4,8-dimethyl-1h,2h,6h,7h-phenanthro[3,4-b]furan-1,2,9-triol

C18H18O4 (298.1205028)


   

(3r)-3-{2,4-dihydroxy-6-[(2r)-2-hydroxypropyl]benzoyloxy}butanoic acid

(3r)-3-{2,4-dihydroxy-6-[(2r)-2-hydroxypropyl]benzoyloxy}butanoic acid

C14H18O7 (298.10524780000003)


   

(5r,6r)-6-ethyl-3-({2-[(1-hydroxyethylidene)amino]ethyl}sulfanyl)-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid

(5r,6r)-6-ethyl-3-({2-[(1-hydroxyethylidene)amino]ethyl}sulfanyl)-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid

C13H18N2O4S (298.0987228)


   

(1r,2s,3r,5s,6s,10r,11r)-3,5,10-trihydroxy-2,6-dimethyl-8,12-dioxatetracyclo[9.2.1.0¹,⁵.0⁶,¹⁰]tetradecane-9,13-dione

(1r,2s,3r,5s,6s,10r,11r)-3,5,10-trihydroxy-2,6-dimethyl-8,12-dioxatetracyclo[9.2.1.0¹,⁵.0⁶,¹⁰]tetradecane-9,13-dione

C14H18O7 (298.10524780000003)


   

10-bromo-3,7,11,11-tetramethylspiro[5.5]undec-7-en-2-one

10-bromo-3,7,11,11-tetramethylspiro[5.5]undec-7-en-2-one

C15H23BrO (298.0932168)


   

(2s,4s)-4-(3-acetyl-2,6-dihydroxy-5-methylphenyl)-4-hydroxy-2-methoxybutanoic acid

(2s,4s)-4-(3-acetyl-2,6-dihydroxy-5-methylphenyl)-4-hydroxy-2-methoxybutanoic acid

C14H18O7 (298.10524780000003)


   

6-ethyl-3-({2-[(1-hydroxyethylidene)amino]ethyl}sulfanyl)-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid

6-ethyl-3-({2-[(1-hydroxyethylidene)amino]ethyl}sulfanyl)-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid

C13H18N2O4S (298.0987228)


   

1-(acetyloxy)tetradeca-4,6-dien-8,10,12-triyn-3-yl acetate

1-(acetyloxy)tetradeca-4,6-dien-8,10,12-triyn-3-yl acetate

C18H18O4 (298.1205028)


   

4-[(2s,3r)-3-methyl-7-[(1e)-prop-1-en-1-yl]-2,3-dihydro-1,4-benzodioxin-2-yl]benzene-1,3-diol

4-[(2s,3r)-3-methyl-7-[(1e)-prop-1-en-1-yl]-2,3-dihydro-1,4-benzodioxin-2-yl]benzene-1,3-diol

C18H18O4 (298.1205028)


   

(2r)-5,7-dimethoxy-6-methyl-2-phenyl-2,3-dihydro-1-benzopyran-4-one

(2r)-5,7-dimethoxy-6-methyl-2-phenyl-2,3-dihydro-1-benzopyran-4-one

C18H18O4 (298.1205028)


   

5,6,13-trimethoxy-2-oxatetracyclo[6.6.2.0⁴,¹⁶.0¹¹,¹⁵]hexadeca-1(14),4,6,8(16),11(15),12-hexaene

5,6,13-trimethoxy-2-oxatetracyclo[6.6.2.0⁴,¹⁶.0¹¹,¹⁵]hexadeca-1(14),4,6,8(16),11(15),12-hexaene

C18H18O4 (298.1205028)


   

(2r,3e)-1-bromo-5-[(1r)-2,2-dimethyl-6-methylidenecyclohex-3-en-1-yl]-3-methylpent-3-en-2-ol

(2r,3e)-1-bromo-5-[(1r)-2,2-dimethyl-6-methylidenecyclohex-3-en-1-yl]-3-methylpent-3-en-2-ol

C15H23BrO (298.0932168)


   

n-{2-hydroxy-5-[5-(hydroxymethyl)-1,3-benzoxazol-2-yl]phenyl}ethanimidic acid

n-{2-hydroxy-5-[5-(hydroxymethyl)-1,3-benzoxazol-2-yl]phenyl}ethanimidic acid

C16H14N2O4 (298.0953524)


   

8-bromo-3,7,7-trimethyl-11-methylidenespiro[5.5]undecan-2-one

8-bromo-3,7,7-trimethyl-11-methylidenespiro[5.5]undecan-2-one

C15H23BrO (298.0932168)


   

(2e)-5-hydroxy-2-[(2e)-1-hydroxy-3-phenylprop-2-en-1-ylidene]-4,6,6-trimethylcyclohex-4-ene-1,3-dione

(2e)-5-hydroxy-2-[(2e)-1-hydroxy-3-phenylprop-2-en-1-ylidene]-4,6,6-trimethylcyclohex-4-ene-1,3-dione

C18H18O4 (298.1205028)


   

[(2r,3s,4s,5r,6r)-3,4,5-trihydroxy-6-methoxyoxan-2-yl]methyl benzoate

[(2r,3s,4s,5r,6r)-3,4,5-trihydroxy-6-methoxyoxan-2-yl]methyl benzoate

C14H18O7 (298.10524780000003)


   

3-(chloromethyl)-3,8-dihydroxy-6,9-dimethylidene-octahydroazuleno[4,5-b]furan-2-one

3-(chloromethyl)-3,8-dihydroxy-6,9-dimethylidene-octahydroazuleno[4,5-b]furan-2-one

C15H19ClO4 (298.0971804)


   

(2e)-3-(3,4-dimethoxyphenyl)prop-2-en-1-yl benzoate

(2e)-3-(3,4-dimethoxyphenyl)prop-2-en-1-yl benzoate

C18H18O4 (298.1205028)


   

2-benzoyl-5-[(3-methylbut-2-en-1-yl)oxy]benzene-1,3-diol

2-benzoyl-5-[(3-methylbut-2-en-1-yl)oxy]benzene-1,3-diol

C18H18O4 (298.1205028)


   

6-(3,4-dihydroxybenzoyloxy)-3-hydroxy-4-methylhexanoic acid

6-(3,4-dihydroxybenzoyloxy)-3-hydroxy-4-methylhexanoic acid

C14H18O7 (298.10524780000003)


   

3-(4-hydroxyphenyl)propyl 3-(4-hydroxyphenyl)prop-2-enoate

3-(4-hydroxyphenyl)propyl 3-(4-hydroxyphenyl)prop-2-enoate

C18H18O4 (298.1205028)


   

5-chloro-7-hydroxy-3'-(hydroxymethyl)-3',8,8a-trimethyl-7,8-dihydro-1h-spiro[naphthalene-2,2'-oxiran]-3-one

5-chloro-7-hydroxy-3'-(hydroxymethyl)-3',8,8a-trimethyl-7,8-dihydro-1h-spiro[naphthalene-2,2'-oxiran]-3-one

C15H19ClO4 (298.0971804)


   

1-(2-{[(2r,3r,4s,5r)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy}-4-hydroxy-5-methylphenyl)ethanone

1-(2-{[(2r,3r,4s,5r)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy}-4-hydroxy-5-methylphenyl)ethanone

C14H18O7 (298.10524780000003)


   

(2s)-5-[2-hydroxy-5-(prop-2-en-1-yl)phenyl]-2-(hydroxymethyl)-2,3-dihydro-1-benzofuran-3-ol

(2s)-5-[2-hydroxy-5-(prop-2-en-1-yl)phenyl]-2-(hydroxymethyl)-2,3-dihydro-1-benzofuran-3-ol

C18H18O4 (298.1205028)


   

4,8-dimethyl-1h,2h,6h,7h-phenanthro[3,4-b]furan-1,2,9-triol

4,8-dimethyl-1h,2h,6h,7h-phenanthro[3,4-b]furan-1,2,9-triol

C18H18O4 (298.1205028)


   

methyl 2,6-dimethoxyphenazine-1-carboxylate

methyl 2,6-dimethoxyphenazine-1-carboxylate

C16H14N2O4 (298.0953524)


   

1-phenyl-2-{[(2r,3r,4s,5r,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}ethanone

1-phenyl-2-{[(2r,3r,4s,5r,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}ethanone

C14H18O7 (298.10524780000003)


   

1-(2-{[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy}-4-hydroxy-5-methylphenyl)ethanone

1-(2-{[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy}-4-hydroxy-5-methylphenyl)ethanone

C14H18O7 (298.10524780000003)


   

(2ar,3s,4ar,5s,8r,8as)-3-bromo-2a,4a,5,8-tetramethyl-hexahydro-1h-cyclobuta[d]inden-7-one

(2ar,3s,4ar,5s,8r,8as)-3-bromo-2a,4a,5,8-tetramethyl-hexahydro-1h-cyclobuta[d]inden-7-one

C15H23BrO (298.0932168)


   

5-hydroxy-2-[(2e)-1-hydroxy-3-phenylprop-2-en-1-ylidene]-4,6,6-trimethylcyclohex-4-ene-1,3-dione

5-hydroxy-2-[(2e)-1-hydroxy-3-phenylprop-2-en-1-ylidene]-4,6,6-trimethylcyclohex-4-ene-1,3-dione

C18H18O4 (298.1205028)


   

4-[5-(3-hydroxypropyl)-1-benzofuran-2-yl]-3-methoxyphenol

4-[5-(3-hydroxypropyl)-1-benzofuran-2-yl]-3-methoxyphenol

C18H18O4 (298.1205028)


   

5-hydroxy-7-methoxy-6,8-dimethyl-2-phenyl-2,3-dihydro-1-benzopyran-4-one

5-hydroxy-7-methoxy-6,8-dimethyl-2-phenyl-2,3-dihydro-1-benzopyran-4-one

C18H18O4 (298.1205028)


   

1,4,6,9-tetramethylpyrido[3,2-g]quinoline-2,5,8,10-tetrone

1,4,6,9-tetramethylpyrido[3,2-g]quinoline-2,5,8,10-tetrone

C16H14N2O4 (298.0953524)


   

2,6-bis(hydroxymethyl)-hexahydropyrano[3,2-b]pyran-3,4,4a,7,8,8a-hexol

2,6-bis(hydroxymethyl)-hexahydropyrano[3,2-b]pyran-3,4,4a,7,8,8a-hexol

C10H18O10 (298.0899928)


   

n-[6-(3-hydroxypropanoyl)-11-imino-2,7-diazatricyclo[6.3.1.0⁴,¹²]dodeca-1,3,5,8(12),9-pentaen-9-yl]ethanimidic acid

n-[6-(3-hydroxypropanoyl)-11-imino-2,7-diazatricyclo[6.3.1.0⁴,¹²]dodeca-1,3,5,8(12),9-pentaen-9-yl]ethanimidic acid

C15H14N4O3 (298.1065854)


   

6-chloro-4-(1,3-dihydroxypropan-2-yl)-5-hydroxy-2,2,7-trimethyl-3h-inden-1-one

6-chloro-4-(1,3-dihydroxypropan-2-yl)-5-hydroxy-2,2,7-trimethyl-3h-inden-1-one

C15H19ClO4 (298.0971804)


   

(1r,3ar,4r,7ar)-1-(acetyloxy)-4,7a-dimethyl-3,7-dioxo-tetrahydro-2-benzofuran-3a-yl acetate

(1r,3ar,4r,7ar)-1-(acetyloxy)-4,7a-dimethyl-3,7-dioxo-tetrahydro-2-benzofuran-3a-yl acetate

C14H18O7 (298.10524780000003)


   

(2r)-5,7,8-trimethoxy-2-phenyl-2h-chromene

(2r)-5,7,8-trimethoxy-2-phenyl-2h-chromene

C18H18O4 (298.1205028)


   

4-[(2s,3s)-3-methyl-7-[(1e)-prop-1-en-1-yl]-2,3-dihydro-1,4-benzodioxin-2-yl]benzene-1,3-diol

4-[(2s,3s)-3-methyl-7-[(1e)-prop-1-en-1-yl]-2,3-dihydro-1,4-benzodioxin-2-yl]benzene-1,3-diol

C18H18O4 (298.1205028)


   

[(5r,7s)-4,5-dimethoxy-7-methyl-2-oxo-5h,7h,8h-pyrano[3,2-c]pyran-3-yl]methyl acetate

[(5r,7s)-4,5-dimethoxy-7-methyl-2-oxo-5h,7h,8h-pyrano[3,2-c]pyran-3-yl]methyl acetate

C14H18O7 (298.10524780000003)


   

(3r)-3,4-bis[(3-hydroxyphenyl)methyl]oxolan-2-one

(3r)-3,4-bis[(3-hydroxyphenyl)methyl]oxolan-2-one

C18H18O4 (298.1205028)


   

1-{2,4-dihydroxy-6-[(1e)-2-(4-hydroxyphenyl)ethenyl]phenyl}-2-methylpropan-1-one

1-{2,4-dihydroxy-6-[(1e)-2-(4-hydroxyphenyl)ethenyl]phenyl}-2-methylpropan-1-one

C18H18O4 (298.1205028)


   

4-[3-methyl-7-(prop-1-en-1-yl)-2,3-dihydro-1,4-benzodioxin-2-yl]benzene-1,3-diol

4-[3-methyl-7-(prop-1-en-1-yl)-2,3-dihydro-1,4-benzodioxin-2-yl]benzene-1,3-diol

C18H18O4 (298.1205028)


   

8-bromo-3,7,7-trimethyl-11-methylidenespiro[5.5]undec-3-en-2-ol

8-bromo-3,7,7-trimethyl-11-methylidenespiro[5.5]undec-3-en-2-ol

C15H23BrO (298.0932168)


   

2-(ethylsulfanyl)-1-{[2-(ethylsulfanyl)butyl]disulfanyl}butane

2-(ethylsulfanyl)-1-{[2-(ethylsulfanyl)butyl]disulfanyl}butane

C12H26S4 (298.0917276)


   

(3z)-1-bromo-5-(2,2-dimethyl-6-methylidenecyclohex-3-en-1-yl)-3-methylpent-3-en-2-ol

(3z)-1-bromo-5-(2,2-dimethyl-6-methylidenecyclohex-3-en-1-yl)-3-methylpent-3-en-2-ol

C15H23BrO (298.0932168)


   

(1r,3ar,4s,7ar)-1-(acetyloxy)-4,7a-dimethyl-3,7-dioxo-tetrahydro-2-benzofuran-3a-yl acetate

(1r,3ar,4s,7ar)-1-(acetyloxy)-4,7a-dimethyl-3,7-dioxo-tetrahydro-2-benzofuran-3a-yl acetate

C14H18O7 (298.10524780000003)


   

(6r)-6-ethyl-3-({2-[(1-hydroxyethylidene)amino]ethyl}sulfanyl)-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid

(6r)-6-ethyl-3-({2-[(1-hydroxyethylidene)amino]ethyl}sulfanyl)-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid

C13H18N2O4S (298.0987228)


   

5-methyl-8-oxo-5,10,20-triazapentacyclo[11.7.1.0²,⁷.0⁹,²¹.0¹⁴,¹⁹]henicosa-1(20),2,4,6,9,11,13(21),14(19),15,17-decaen-5-ium

5-methyl-8-oxo-5,10,20-triazapentacyclo[11.7.1.0²,⁷.0⁹,²¹.0¹⁴,¹⁹]henicosa-1(20),2,4,6,9,11,13(21),14(19),15,17-decaen-5-ium

[C19H12N3O]+ (298.0980322)


   

(2ar,3s,4ar,5s,8s,8as)-3-bromo-2a,4a,5,8-tetramethyl-hexahydro-1h-cyclobuta[d]inden-7-one

(2ar,3s,4ar,5s,8s,8as)-3-bromo-2a,4a,5,8-tetramethyl-hexahydro-1h-cyclobuta[d]inden-7-one

C15H23BrO (298.0932168)


   

methyl (2z)-2-(n-hydroxyimino)-3-{7-[(1e)-3-methylbuta-1,3-dien-1-yl]-1h-indol-3-yl}propanoate

methyl (2z)-2-(n-hydroxyimino)-3-{7-[(1e)-3-methylbuta-1,3-dien-1-yl]-1h-indol-3-yl}propanoate

C17H18N2O3 (298.1317358)


   

methyl (2r,4r)-4-(3-acetyl-2,6-dihydroxyphenyl)-4-hydroxy-2-methoxybutanoate

methyl (2r,4r)-4-(3-acetyl-2,6-dihydroxyphenyl)-4-hydroxy-2-methoxybutanoate

C14H18O7 (298.10524780000003)