Exact Mass: 360.14086000000003
Exact Mass Matches: 360.14086000000003
Found 500 metabolites which its exact mass value is equals to given mass value 360.14086000000003,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Triptolide
Triptolide is an organic heteroheptacyclic compound, an epoxide, a gamma-lactam and a diterpenoid. It has a role as an antispermatogenic agent and a plant metabolite. Triptolide has been used in trials studying the treatment of HIV, Crohns Disease, Intestinal Diseases, Gastrointestinal Diseases, and Digestive System Diseases, among others. Triptolide is a natural product found in Tripterygium hypoglaucum, Celastraceae, and other organisms with data available. D012102 - Reproductive Control Agents > D003270 - Contraceptive Agents D007155 - Immunologic Factors > D007166 - Immunosuppressive Agents D009676 - Noxae > D000988 - Antispermatogenic Agents D009676 - Noxae > D000477 - Alkylating Agents D000970 - Antineoplastic Agents Triptolide is a diterpenoid triepoxide extracted from the root of Tripterygium wilfordii with immunosuppressive, anti-inflammatory, antiproliferative and antitumour effects. Triptolide is a NF-κB activation inhibitor[1][2][3][4][5][6]. Triptolide is a diterpenoid triepoxide extracted from the root of Tripterygium wilfordii with immunosuppressive, anti-inflammatory, antiproliferative and antitumour effects. Triptolide is a NF-κB activation inhibitor[1][2][3][4][5][6].
Nitrendipine
Nitrendipine is only found in individuals that have used or taken this drug. It is a calcium channel blocker with marked vasodilator action. It is an effective antihypertensive agent and differs from other calcium channel blockers in that it does not reduce glomerular filtration rate and is mildly natriuretic, rather than sodium retentive. [PubChem]By deforming the channel, inhibiting ion-control gating mechanisms, and/or interfering with the release of calcium from the sarcoplasmic reticulum, Nitrendipine inhibits the influx of extracellular calcium across the myocardial and vascular smooth muscle cell membranes The decrease in intracellular calcium inhibits the contractile processes of the myocardial smooth muscle cells, causing dilation of the coronary and systemic arteries, increased oxygen delivery to the myocardial tissue, decreased total peripheral resistance, decreased systemic blood pressure, and decreased afterload. C - Cardiovascular system > C08 - Calcium channel blockers > C08C - Selective calcium channel blockers with mainly vascular effects > C08CA - Dihydropyridine derivatives C78274 - Agent Affecting Cardiovascular System > C270 - Antihypertensive Agent > C333 - Calcium Channel Blocker D002317 - Cardiovascular Agents > D002121 - Calcium Channel Blockers D002317 - Cardiovascular Agents > D000959 - Antihypertensive Agents D002317 - Cardiovascular Agents > D014665 - Vasodilator Agents D000077264 - Calcium-Regulating Hormones and Agents CONFIDENCE standard compound; INTERNAL_ID 8498 CONFIDENCE standard compound; INTERNAL_ID 2309 D049990 - Membrane Transport Modulators C93038 - Cation Channel Blocker
Deoxyloganic acid
8-Epideoxyloganic acid (7-Deoxy-8-epiloganic acid), an iridoid glucoside, can be found in Incarvillea delavayi. 8-Epideoxyloganic acid exhibits weak antinociceptive activity[1]. 8-Epideoxyloganic acid (7-Deoxy-8-epiloganic acid), an iridoid glucoside, can be found in Incarvillea delavayi. 8-Epideoxyloganic acid exhibits weak antinociceptive activity[1].
(+)-lariciresinol
(+)-Lariciresinol belongs to the class of organic compounds known as 7,9-epoxylignans. These are lignans that contain the 7,9-epoxylignan skeleton, which consists of a tetrahydrofuran that carries a phenyl group, a methyl group, and a benzyl group at positons 2, 3 and 4, respectively. (+)-Lariciresinol has been detected in several different foods, such as parsnips, white mustards, narrowleaf cattails, turnips, and common sages. This could make (+)-Lariciresinol a potential biomarker for the consumption of these foods. Lariciresinol is also found in sesame seeds, Brassica vegetables, in the bark and wood of white fir (Abies alba). (+)-lariciresinol is a member of the class of compounds known as 7,9-epoxylignans. 7,9-epoxylignans are lignans that contain the 7,9-epoxylignan skeleton, which consists of a tetrahydrofuran that carries a phenyl group, a methyl group, and a benzyl group at the 2-, 3-, 4-position, respectively (+)-lariciresinol is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). (+)-lariciresinol can be found in a number of food items such as pili nut, lemon balm, root vegetables, and parsley, which makes (+)-lariciresinol a potential biomarker for the consumption of these food products.
Dibenzo-18-crown-6
AL-294
C21H25ClO3 (360.14921300000003)
Valacyclovir hydrochloride
C13H21ClN6O4 (360.13127360000004)
D000890 - Anti-Infective Agents > D000998 - Antiviral Agents C471 - Enzyme Inhibitor > C29575 - DNA Polymerase Inhibitor C254 - Anti-Infective Agent > C281 - Antiviral Agent Valacyclovir hydrochloride (Valaciclovir hydrochloride) is an orally active antiviral agent for herpes simplex, herpes zoster, and herpes B. Valacyclovir hydrochloride inhibits HSV-1 W (50=2.9 μg/ml). Valacyclovir hydrochloride is a proagent of Aciclovir (HY-17422) [1][2][3][4][5].
(-)-lariciresinol
A lignan that is tetrahydrofuran substituted at positions 2, 3 and 4 by 4-hydroxy-3-methoxyphenyl, hydroxymethyl and 4-hydroxy-3-methoxybenzyl groups respectively (the 2R,3S,4S-diastereomer).
8-Epideoxyloganic acid
8-Epideoxyloganic acid (7-Deoxy-8-epiloganic acid), an iridoid glucoside, can be found in Incarvillea delavayi. 8-Epideoxyloganic acid exhibits weak antinociceptive activity[1]. 8-Epideoxyloganic acid (7-Deoxy-8-epiloganic acid), an iridoid glucoside, can be found in Incarvillea delavayi. 8-Epideoxyloganic acid exhibits weak antinociceptive activity[1].
Casegravol isovalerate
Casegravol isovalerate is found in citrus. Casegravol isovalerate is a constituent of Citrus unshiu (satsuma mandarin). Constituent of Citrus unshiu (satsuma mandarin). Casegravol isovalerate is found in citrus.
2-(4-Hydroxy-3,5-dimethoxyphenyl)ethanol 4'-glucoside
2-(4-Hydroxy-3,5-dimethoxyphenyl)ethanol 4-glucoside is found in fruits. 2-(4-Hydroxy-3,5-dimethoxyphenyl)ethanol 4-glucoside is a constituent of the roots of Phyllanthus emblica (emblic). Constituent of the roots of Phyllanthus emblica (emblic). 2-(4-Hydroxy-3,5-dimethoxyphenyl)ethanol 4-glucoside is found in fruits.
2'-Methoxy-3-(2,4-dihydroxyphenyl)-1,2-propanediol 4'-glucoside
Constituent of the fruit of Anethum graveolens (dill). 2-Methoxy-3-(2,4-dihydroxyphenyl)-1,2-propanediol 4-glucoside is found in dill. 2-Methoxy-3-(2,4-dihydroxyphenyl)-1,2-propanediol 4-glucoside is a constituent of the fruit of Anethum graveolens (dill).
4-Acetylzearalenone
4-Acetyl-cis-zearalenone is a metabolite of Fusarium graminearum. Metabolite of Fusarium graminearum
1-(3,4-Dimethoxyphenyl)-1,2-ethanediol 2-O-b-D-glucoside
1-(3,4-Dimethoxyphenyl)-1,2-ethanediol 2-O-b-D-glucoside is found in herbs and spices. 1-(3,4-Dimethoxyphenyl)-1,2-ethanediol 2-O-b-D-glucoside is a constituent of fennel (Foeniculum vulgare) Constituent of fennel (Foeniculum vulgare). 1-(3,4-Dimethoxyphenyl)-1,2-ethanediol 2-O-b-D-glucoside is found in herbs and spices.
6'-O-Formylmarmin
6-O-Formylmarmin is found in citrus. 6-O-Formylmarmin is a constituent of Citrus hassaku. Constituent of Citrus hassaku. (R)-6-O-Formylmarmin is found in citrus.
3',4',5',7,8-Pentamethoxyflavan
3,4,5,7,8-Pentamethoxyflavan is found in fruits. 3,4,5,7,8-Pentamethoxyflavan is a constituent of the roots of Muntingia calabura (Jamaica cherry). Constituent of the roots of Muntingia calabura (Jamaica cherry). 3,4,5,7,8-Pentamethoxyflavan is found in fruits.
1-(3,4-Dimethoxyphenyl)-1,2-ethanediol 1-O-b-D-glucoside
1-(3,4-Dimethoxyphenyl)-1,2-ethanediol 1-O-b-D-glucoside is found in herbs and spices. 1-(3,4-Dimethoxyphenyl)-1,2-ethanediol 1-O-b-D-glucoside is a constituent of fennel (Foeniculum vulgare) Constituent of fennel (Foeniculum vulgare). 1-(3,4-Dimethoxyphenyl)-1,2-ethanediol 1-O-b-D-glucoside is found in herbs and spices.
Dityrosine
Dityrosine is a fluorescent molecule formed as a result of normal posttranslational processing. In many structural proteins, dityrosine confers resistance to proteolysis and physicochemical trauma as a stabilizing crosslink. Dityrosine has also been found in oxidative/nitrative stress under a variety of conditions and biological systems. In this regard, it has been used as an important biomarker for oxidatively modified proteins during UV and gamma-irradiation, aging, and exposure to oxygen free radicals, nitrogen dioxide, peroxynitrite, and lipid hydroperoxides. Renewed interest in dityrosine and other tyrosine oxidation products as clinical indicators of oxidative modification has driven the development of important techniques for the specific analysis and quantification of these molecules. The presence of elevated levels of dityrosine in mammalian tissue and urine samples has been measured by chromatographic separation followed by mass spectrometry GC-MS and HPLC-MS/MS. Increases in dityrosine levels have been associated with pathologies such as eye cataracts, atherosclerosis, acute inflammation, and Alzheimers disease. The continued development of, and increased accessibility to, improved mass spectrometric instrumentation will expand the capability, feasibility, and sensitivity with which specific biomarkers like dityrosine can be measured. (PMID: 17019703) [HMDB] Dityrosine is a fluorescent molecule formed as a result of normal posttranslational processing. In many structural proteins, dityrosine confers resistance to proteolysis and physicochemical trauma as a stabilizing crosslink. Dityrosine has also been found in oxidative/nitrative stress under a variety of conditions and biological systems. In this regard, it has been used as an important biomarker for oxidatively modified proteins during UV and gamma-irradiation, aging, and exposure to oxygen free radicals, nitrogen dioxide, peroxynitrite, and lipid hydroperoxides. Renewed interest in dityrosine and other tyrosine oxidation products as clinical indicators of oxidative modification has driven the development of important techniques for the specific analysis and quantification of these molecules. The presence of elevated levels of dityrosine in mammalian tissue and urine samples has been measured by chromatographic separation followed by mass spectrometry GC-MS and HPLC-MS/MS. Increases in dityrosine levels have been associated with pathologies such as eye cataracts, atherosclerosis, acute inflammation, and Alzheimers disease. The continued development of, and increased accessibility to, improved mass spectrometric instrumentation will expand the capability, feasibility, and sensitivity with which specific biomarkers like dityrosine can be measured. (PMID: 17019703).
Quassinol
Quassinol is a constituent of Quassia amara (Surinam quassia). Constituent of Quassia amara (Surinam quassia)
2,2'-Bityrosine
Bay 41-2272
C20H17FN6 (360.14986539999995)
Benzoporphyrin
Delmadinone
C21H25ClO3 (360.14921300000003)
Eddha
D064449 - Sequestering Agents > D002614 - Chelating Agents > D007502 - Iron Chelating Agents
Isolariciresinol
Isolariciresinol is a member of the class of compounds known as 9,9p-dihydroxyaryltetralin lignans. 9,9p-dihydroxyaryltetralin lignans are lignans with a structure based on the 1-phenyltetralin skeleton carrying a hydroxyl group at the 9- and the 9- position. Isolariciresinol is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Isolariciresinol can be found in grape wine, which makes isolariciresinol a potential biomarker for the consumption of this food product.
Lariciresinol
(-)-lariciresinol is a member of the class of compounds known as 7,9-epoxylignans. 7,9-epoxylignans are lignans that contain the 7,9-epoxylignan skeleton, which consists of a tetrahydrofuran that carries a phenyl group, a methyl group, and a benzyl group at the 2-, 3-, 4-position, respectively (-)-lariciresinol is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). (-)-lariciresinol can be found in a number of food items such as cassava, acorn, celeriac, and banana, which makes (-)-lariciresinol a potential biomarker for the consumption of these food products.
LL-dityrosine
triptolide
5-O-Ethyl 3-O-methyl (4S)-2,6-dimethyl-4-(3-nitrophenyl)-3,4-dihydropyridine-3,5-dicarboxylate
Cyclolariciresinol
Cyclolariciresinol is a member of the class of compounds known as 9,9p-dihydroxyaryltetralin lignans. 9,9p-dihydroxyaryltetralin lignans are lignans with a structure based on the 1-phenyltetralin skeleton carrying a hydroxyl group at the 9- and the 9- position. Cyclolariciresinol is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Cyclolariciresinol can be found in sesame, which makes cyclolariciresinol a potential biomarker for the consumption of this food product.
Isodityrosine
Isodityrosine belongs to tyrosine and derivatives class of compounds. Those are compounds containing tyrosine or a derivative thereof resulting from reaction of tyrosine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom. Isodityrosine is practically insoluble (in water) and a moderately acidic compound (based on its pKa). Isodityrosine can be found in potato, which makes isodityrosine a potential biomarker for the consumption of this food product.
Invert sugar
Inverted or invert sugar syrup is a mixture of glucose and fructose; it is obtained by splitting sucrose into these two components. Compared with its precursor, sucrose, inverted sugar is sweeter and its products tend to remain more moist and are less prone to crystallisation. Inverted sugar is therefore valued by bakers, who refer to the syrup as trimoline or invert syrup. Invert sugar is found in fig and black elderberry. C - Cardiovascular system > C05 - Vasoprotectives > C05B - Antivaricose therapy > C05BB - Sclerosing agents for local injection D001697 - Biomedical and Dental Materials > D002326 - Cariogenic Agents D000074385 - Food Ingredients > D005503 - Food Additives D010592 - Pharmaceutic Aids > D005421 - Flavoring Agents
(-)-lactol
(-)-lactol is a member of the class of compounds known as dibenzylbutyrolactols. Dibenzylbutyrolactols are lignan compounds containing a 3,4-dibenzyloxolan-2-ol moiety (-)-lactol is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). (-)-lactol can be found in a number of food items such as corn salad, sugar apple, abalone, and giant butterbur, which makes (-)-lactol a potential biomarker for the consumption of these food products.
indole-3-acetyl-tryptophan
C21H18N3O3 (360.13480979999997)
Indole-3-acetyl-tryptophan is also known as iaa-trp. Indole-3-acetyl-tryptophan is practically insoluble (in water) and a weakly acidic compound (based on its pKa). Indole-3-acetyl-tryptophan can be found in a number of food items such as giant butterbur, cassava, skunk currant, and mulberry, which makes indole-3-acetyl-tryptophan a potential biomarker for the consumption of these food products.
Eupalinilide B
[3aR-[3aalpha,4beta(Z),6alpha,7beta,7abeta]]-6-Ethenyloctahydro-6-methyl-a,3-bis(methylene)-4-[(2-methyl-1-oxo-2-butenyl)oxy]-2-oxo-7-benzofuranacetic acid
Brosimacutin I
4-[10-Hydroxy-6-hydroperoxy-7,9-dehydro-6,7-dihydrogeranyloxy]-5-methylcoumarin
(8R,8R,9R)-4,4,9-trihydroxy-3,3-dimethoxy-9,9-epoxylignan
2-Senecioyl-4-[1-(4-acetoxyangeloyloxyethyl)]-phenol
3-Oxo-4beta,10beta-dihydroxy-15,16-epoxy-cis-clerodane-8(17),13(16),14-trien-20,12-olide
4-[10-Hydroxy-7-hydroperoxy-5,6E-dehydro-6,7-dihydrogeranyloxy]-5-methylcoumarin
[3aS-[3aalpha,4beta(Z),5beta,6alpha,7alpha,7abeta]]- 6-Ethenyl-5-(1-formylethenyl)octahydro-7-hydroxy-6-methyl-3-methylene-2-oxo-4-benzofuranyl ester 2-methyl-2-butenoic acid
Dihydrodehydrodiconiferyl alcohol
D001697 - Biomedical and Dental Materials
10beta-Hydroxy-6-oxo-3alpha,4alpha,15,16-bisepoxy-labda-13(16),14-dien-20,12-olide
Austradiol acetate
10beta-Hydroxy-3alpha,4alpha,15,16-8beta,12alpha-triepoxy-cis-clerodane-13(16),14-dien-20,1beta-olide
Eupaheliangolide A
A sesquiterpene lactone of the heliangolide group isolated from Eupatorium kiirunense and exhibits cytotoxicity against human oral epidermoid (KB), cervical epitheloid (Hela) and liver (hepa59T/VGH) carcinoma cells.
Heliopsolide
4-[4-Hydroxy-7-hydroperxy-5,6E-dehydro-6,7-dihydrogeranyloxy]-5-methylcoumarin
3alpha,4alpha-Epoxy-8beta-hydroxy-6-oxo-15,16-epoxy-cis-clerodane-13(16),14-dien-20,12-olide
4-[4-Hydroxy-6-epi-hydroperoxy-7,9-dehydro-6,7-dihydrogeranyloxy]-5-methylcoumarin
[3aS-[3aalpha,4beta,5beta,6alpha,7alpha(Z),7abeta]]- 6-Ethenyl-5-(1-formylethenyl)octahydro-4-hydroxy-6-methyl-3-methylene-2-oxo-7-benzofuranyl ester 2-methyl-2-butenoic acid
[3aR-[3aalpha,4beta(E),6alpha,7beta,7abeta]]-6-ethenyloctahydro-6-methyl-a,3-bis(methylene)-4-[(2-methyl-1-oxo-2-butenyl)oxy]-2-oxo-7-benzofuranacetic acid
Epideoxyloganic acid
8-Epideoxyloganic acid (7-Deoxy-8-epiloganic acid), an iridoid glucoside, can be found in Incarvillea delavayi. 8-Epideoxyloganic acid exhibits weak antinociceptive activity[1]. 8-Epideoxyloganic acid (7-Deoxy-8-epiloganic acid), an iridoid glucoside, can be found in Incarvillea delavayi. 8-Epideoxyloganic acid exhibits weak antinociceptive activity[1].
4-[4-Hydroxy-6-hydroperoxy-7,9-dehydro-6,7-dihydrogeranyloxy]-5-methylcoumarin
(5R)-1-(3,4-Dihydroxyphenyl)-5-hydroxy-7-(4-hydroxy-3-methoxyphenyl)-3-heptanone
[(3aR,4R,5R,6E,9Z,11aR)-4-hydroxy-6,10-dimethyl-3-methylidene-2,8-dioxo-4,5,11,11a-tetrahydro-3aH-cyclodeca[b]furan-5-yl] (Z)-2-methylbut-2-enoate
3alpha,4alpha-epoxyrupicolin C|3??,4??-Epoxyrupicolin C|8-angeloyloxy-1alpha-hydroxy-3alpha,4alpha-epoxy-5alpha,7alphaH-10(14),11(13)-guaiadien-12,6alpha-olide
3beta-(angeloyloxy)-(8betaH)-eremophil-7(11)-ene-12,8alpha;14,6alpha-diolide
7-[(3,7-Dimethyl-5-hydroxy-2,3-epoxy-6-octene-1-yl)oxy]-8-methoxycoumarin
8beta-hydroxy-9alpha-angeloyloxy-14-oxo-acanthospermolide
8??-(4-Hydroxytigloyloxy)-2??-hydroxy-1??H,5??H,6??H,7??H-guai-3,10(14),11(13)-trien-6,12-olide
1(10)E-(4R,5R,7S,8S)-4,5-epoxy-14-oxo-15-senecioyloxygermacra-1(10),11(13)-dien-8,12-olide
(11beta,15S)-6,11,17-trihydroxy-7,20-dioxo-ent-abieta-5,8(14)-dien-16-oic acid delta-lactone|(1S,4S,5R,12aR,12bS)-1,3,4,5,7,9,10,11,12,12b-decahydro-8-hydroxy-4-(hydroxymethyl)-9,9-dimethyl-3,7-dioxo-1,5-methano-12aH-naphth[1,2-c]oxocin-12a-carbaldehyde|xerophilusin S
12(S)-15,16-epoxy-19-hydroxy-neo-cleroda-13(16),14-dien-18,6a:20,12-diolide
(6R,7R,8R)-3-Oxo-8-sarracenyloxyhelianga-1(10),4,11(13)-trien-6,12-olide
(5RS,6RS)-5-[(beta-D-glucopyranosyloxy)methyl]-4,5,6,8-tetrahydro-6-methyl-1H,3H-pyrano[3,4-c]pyran-1-one|(5RS,6SR)-5-[(beta-D-glucopyranosyloxy)methyl]-4,5,6,8-tetrahydro-6-methyl-1H,3H-pyrano[3,4-c]pyran-1-one|swertiajaposide D|swertiajaposide E
(2R,3S,4S)-4,5,4-trimethoxy-6,8-dimethyl-3,7-dihydroxy-flavan
(+)-3,4,7,3,4-pentamethoxy-2,3-trans-3,4-cis-flavan|3,3,4,4,7-Pentamethoxyflavan
3,4-Bis(3-methoxy-4-hydroxybenzyl)tetrahydrofuran-2-ol
7-hydroxy-8-(3-methoxy-2-senecioyloxyisopentyl) coumarin
(2S,3S,1SR,2R)-2,3-dihydro-5-(1,2-dihydroxypropyl)-2-(4-hydroxy-3-methoxyphenyl)-7-methoxy-3-methylbenzofuran
8beta-angeloyloxy-9beta-hydroxy-14-oxo-acanthospermolide
14-angeloyloxy-3beta-hydroxydeltonorcacalol
A natural product found in Parasenecio deltophyllus.
8alpha-(2,3-epoxy-2-methylbutyryloxy)-9alpha-hydroxy-(11,13)-dehydromontahibisciolide
(16R)-12,16-epoxy-11,14,17-trihydroxy-17(15->16)-abeo-abieta-8,11,13-triene-2,7-dione|17-hydroxyteuvincenone G
5-[4-hydroxy-6-(4-hydroxyphenethyl)tetrahydro-2H-pyran-2-yl]-3-methoxybenzene-1,2-diol
Eupahualin C
3beta-hydroxyligustrin-8-O-<2-(2-hydroxyethyl)-acrylate>|3beta-hydroxyligustrin-8-O-[2-(2-hydroxyethyl)-acrylate]
(1S, 3S, 5R, 6R, 7R, 8S)-3-hydroxy-8-<2-(1-hydroxyethyl)-propenoyloxy>guai-4(15), 10(14), 11(13)-triene-6,12-olide|(1S, 3S, 5R, 6R, 7R, 8S)-3-hydroxy-8-[2-(1-hydroxyethyl)-propenoyloxy]guai-4(15), 10(14), 11(13)-triene-6,12-olide
2-deethoxy-2-methoxyphantomolin|2beta-methoxy-2-deethoxy-phantomolin
semperoside|semperoside A|[2aS,4S,4aR,7R,7aS,7bS]-4-methyl-7-([2S,3R,4R,5R,6R]-3,4,5-trihydroxy-6-hydroxymethyl-tetrahydropyran-2-yloxy)octahydro-2,6-dioxa-cyclopenta[cd]inden-1-one
1alpha-hydroperoxy-8beta-tigloyloxyguaia-3,9,11(13)-trien-12,6alpha-olide
8beta-Tigloyloxycronquistianthussaeure|cronquistic acid
Tri-Ac-6,12-Tetradecadiene-8,10-diyne-1,3,14-triol,
7-(3,7-dimethyl-6,7-epoxy-5-hydroxyoct-2-enyloxy)-8-methoxycoumarin|hydroxyepoxycollinin I
8-Desacyl-15-desoxypunctatin-8-((2R*,3R*)-2-methyl-2,3-epoxybutyrat)|8-Desacyl-15-desoxypunctatin-8-<(2R*,3R*)-2-methyl-2,3-epoxybutyrat>
7-(5,6-dihydroxy-3,7-dimethylocta-2,7-dienyloxy)-8-methoxycoumarin|hydroxyschininallylol
8beta-(4,5-dihydroxytgloyloxy)-2-desoxodehydroleucodin
3,4,5-trimethoxybenzyl alcohol-7-O-beta-D-glucopyranoside|3,4,5-trimethoxybenzyl beta-D-glucopyranoside|nikoenoside
(7,8-cis-8,8-trans)-2,4-Dihydroxyl-3,5-dimethoxyl-lariciresinol
Tri-Ac-4,12-Tetradecadiene-8,10-diyne-1,6,7-triol,
2beta-Hydroxyligustin-8-((2S*,3S*)-2-methyl-2,3-epoxybutyrat)|2beta-Hydroxyligustin-8-<(2S*,3S*)-2-methyl-2,3-epoxybutyrat>
(3S,4S,5R,7R)-5-(9-methylprop-8-enyl)-1,6-dioxabicyclo[3,2,0]heptan-2-one-7-(hydroxymethyl)-12-O-beta-D-glucopyranoside|aruncide C
3,3-dimethoxy-4,5,7-trihrdroxy-8,4-oxyneolign-7E-ene|3,3-dimethoxy-4,5,7-trihydroxy-8,4-oxyneolign-7E-ene
1R,5R,6R,7R,8R,10S,11R-2,14-dioxo-8-tigloyloxyguai-3-ene-6,12-olide
5S,6R,7R,8R,11R-14-hydroxy-2-oxo-8-tigloyloxyguaia-1(10),3-diene-6,12-olide
15-alpha-hydroxy-6,7-seco-1alpha,7:11alpha,6-diolide-20-al-ent-kaur-16-ene|15alpha-hydroxy-20-oxo-6,7-seco-ent-kaur-16-en-1,7alpha(6,11alpha)-diolide|15alpha-hydroxy-6,7-seco-1alpha,7:11alpha,6-diolide-ent-kaur-16-ene
(S)-(-)-3-(2-hydroxy-3,4,6,trimethoxyphenyl)-1-phenylpropyl acetate|welwitschin D
n-butyl 3,4-dihydroxy-5-(hydroxymethyl)-4-O-[5-(hydroxymethyl)furan-2-yl]tetrahydrofuran-2-carboxylate
(8S,8R)-7-(2,4-dihydroxy-5-methoxyphenyl)-7-(2-methoxy-4,5-methylenedioxyphenyl)-8,8?-dimethylbutane|saurulignan B
(7R,8S)-3,5-dimethoxy-4,7-epoxy-8,3-neolignane-5,9,9-triol
1-(3,4-dihydro-2,2-dimethyl-4-oxo-2H-chromen-6-yl)ethyl (2Z)-2-[(acetyloxy)methyl]but-2-enoate|uniflorol A acetate
1-(3,4-dihydro-2,2-dimethyl-4-oxo-2H-chromen-6-yl)ethyl (2Z)-4-(acetyloxy)-2-methylbut-2-enoate|2,2-dimethyl-6-[1-(4-acetoxyangeloyloxy)ethyl]chroman-4-one
beta-D-glucopyranosyl 7-carboxy-2-methyl-2E,4E-octadienate
3-(3,4-dihydroxybenzyl)-4-[(7S),7-hydroxy-3,5-dimethoxybenzyl]tetrahydrofuran|acanthosessilin A
1-[4-hydroxy-3-(3-methylbut-2-enoyl)phenyl]ethyl (2Z)-2-[(acetyloxy)methyl]but-2-enoate|2-senecioyl-4-[1-(acetylsarracinoyloxy)ethyl]phenol
(3S, 5R, 6R, 7R, 8S)-8-angelyloxy-3,14-dihydroxyguai-1(10), 4(15), 11(13)-triene-6,12-olide
8-O-(2-methoxymethyl-2-propenoyl)-3-hydroxy-4(15),10(14),11(13)-guaiatrien-12,6-olide
3beta-hydroxy-6,7-seco-6,19:6,20-diepoxy-1alpha,7-olide-ent-kaur-16-en-15-one|sculponeatin I
(3R,4S,5R,6R)-6-(hydroxymethyl)-3,4-bis(phenylmethoxy)oxane-2,5-diol
2,3-dihydro-5-hydroxy-3-(hydroxymethyl)-2-[4-(3-hydroxypropyl)-3-mehtoxyphenyl]-6-methoxy-1-benzofuran|lawsonicin
<1S,3S,4R,5S,6S,7R,8R>-8-angeloxy-3,4-epoxy-2-hydroxyguaia-1(10),11(13)-dien-6,12-olide
3,4:15,16-diepoxy-7-oxo-13(16),14-clerodadien-20,12-olide-8beta-Hydroxy
(1R,4S,5E,8Z,10R,12E,14S)-4-hydroperoxycembra-5,8,12,16-tetraene-15,14;19,10-diolide|4-hydroperoxy-5-en-ovatodiolide|4alpha-hydroperoxy-5-enovatodiolide
(S,S)-form---Isodityrosine|Dihydrochloride-S,S---Isodityrosine|Isodityrosine
12,16-epoxy-6,11,14,15-tetrahydroxy-17(15-16)abeo-5,8,11,13-abietatetraen-7-one
2,5-epoxy-2beta-hydroxy-8alpha-(2-methylbut-2-enoyloxy)-4(15),10(14),11(13)-germacratrien-12,6alpha-olide
(2aS,3R,5S,5aS,7R,8aR,8bR)-5-(furan-3-yl)-3,4,4,5,5,5a,7,8,8a,8b-decahydro-8b-(hydroxymethyl)-7-methylspiro[furan-3(2H),6-[6H]naphtho[1,8-bc]furan]-2,2,(2aH)-dionekinalborin C
7-(2,6-Dihydroxy-3-methylene-7-methyl-7-octenyloxy)-8-methoxycoumarin
3,4,9,9-Tetrahdydroxy-4,5-dimethoxy-2,7-cyclolignan|Isolariaresinol-6-methyl-ether
1-oxo-6beta-senecioyloxy-8alpha-hydroxyeremophil-7(11),9(10)-dien-8beta(12)-olide|1-Oxo-6??-senecioyloxy-8??-hydroxyeremophil-7(11),9-(10)-dien-8??(12)-olide
8beta-methacryloyloxymelampolid-14-oic acid methyl ester
8beta-(4-hydroxytigloyloxy)-3-dehydro-4beta,15-dihydrozaluzanin C
junipediol A 2-O-beta-D-glucopyranoside|junipediol A 4-O-beta-D-glucopyranoside|Junipediol A 4-O-??-D-glucopyranoside
12-Hydroxy-6,11,14-trioxo-8,12-abietadien-18-oic acid
8beta-hydroxy-9alpha-methacryloyloxy-14-oxo-acanthospermolide
(+)-miliusane XVI|9beta-acetoxy-1beta-(2,6-dimethyl-5-oxo-hepta-1,6-dienyl)-2-oxa-spiro[4.5]dec-7-ene-3,6-dione
isolariciresinol
(+)-isolariciresinol is a lignan that is 5,6,7,8-tetrahydronaphthalen-2-ol substituted by hydroxymethyl groups at positions 6 and 7, a methoxy group at position 3 and a 4-hydroxy-3-methoxyphenyl group at position 8. It has been isolated from the roots of Rubia yunnanensis. It has a role as a plant metabolite. It is a lignan, a polyphenol, a primary alcohol and a member of guaiacols. Isolariciresinol is a natural product found in Salacia chinensis, Fitzroya cupressoides, and other organisms with data available. See also: Acai fruit pulp (part of). A lignan that is 5,6,7,8-tetrahydronaphthalen-2-ol substituted by hydroxymethyl groups at positions 6 and 7, a methoxy group at position 3 and a 4-hydroxy-3-methoxyphenyl group at position 8. It has been isolated from the roots of Rubia yunnanensis. D001697 - Biomedical and Dental Materials
Sculponeatin B
Sculponeatin B is a natural product found in Isodon phyllostachys with data available.
Maltose monohydrate
Maltose monohydrate is the energy source for bacteria. Maltose monohydrate is the energy source for bacteria.
Deoxyloganic acid
Deoxyloganic acid is a glycoside and an iridoid monoterpenoid. 7-Methyl-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylic acid is a natural product found in Aria edulis and Incarvillea arguta with data available. Deoxyloganic acid is found in herbs and spices. Deoxyloganic acid is a constituent of Nepeta cataria (catnip). Constituent of Nepeta cataria (catnip). Deoxyloganic acid is found in tea and herbs and spices. 8-Epideoxyloganic acid (7-Deoxy-8-epiloganic acid), an iridoid glucoside, can be found in Incarvillea delavayi. 8-Epideoxyloganic acid exhibits weak antinociceptive activity[1]. 8-Epideoxyloganic acid (7-Deoxy-8-epiloganic acid), an iridoid glucoside, can be found in Incarvillea delavayi. 8-Epideoxyloganic acid exhibits weak antinociceptive activity[1].
Lariciresinol
(+)-lariciresinol is a lignan that is tetrahydrofuran substituted at positions 2, 3 and 4 by 4-hydroxy-3-methoxyphenyl, hydroxymethyl and 4-hydroxy-3-methoxybenzyl groups respectively (the 2S,3R,4R-diastereomer). It has a role as an antifungal agent and a plant metabolite. It is a member of oxolanes, a member of phenols, a lignan, a primary alcohol and an aromatic ether. It is an enantiomer of a (-)-lariciresinol. Lariciresinol is a natural product found in Magnolia kachirachirai, Euterpe oleracea, and other organisms with data available. See also: Acai fruit pulp (part of). A lignan that is tetrahydrofuran substituted at positions 2, 3 and 4 by 4-hydroxy-3-methoxyphenyl, hydroxymethyl and 4-hydroxy-3-methoxybenzyl groups respectively (the 2S,3R,4R-diastereomer). (-)-lariciresinol is a member of the class of compounds known as 7,9-epoxylignans. 7,9-epoxylignans are lignans that contain the 7,9-epoxylignan skeleton, which consists of a tetrahydrofuran that carries a phenyl group, a methyl group, and a benzyl group at the 2-, 3-, 4-position, respectively (-)-lariciresinol is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). (-)-lariciresinol can be found in a number of food items such as ostrich fern, pepper (c. frutescens), ohelo berry, and guava, which makes (-)-lariciresinol a potential biomarker for the consumption of these food products. Annotation level-1 relative retention time with respect to 9-anthracene Carboxylic Acid is 0.823 relative retention time with respect to 9-anthracene Carboxylic Acid is 0.820 relative retention time with respect to 9-anthracene Carboxylic Acid is 0.818 relative retention time with respect to 9-anthracene Carboxylic Acid is 0.812
triptolide
relative retention time with respect to 9-anthracene Carboxylic Acid is 0.848 D012102 - Reproductive Control Agents > D003270 - Contraceptive Agents D007155 - Immunologic Factors > D007166 - Immunosuppressive Agents D009676 - Noxae > D000988 - Antispermatogenic Agents D009676 - Noxae > D000477 - Alkylating Agents D000970 - Antineoplastic Agents relative retention time with respect to 9-anthracene Carboxylic Acid is 0.842 relative retention time with respect to 9-anthracene Carboxylic Acid is 0.835 Triptolide is a diterpenoid triepoxide extracted from the root of Tripterygium wilfordii with immunosuppressive, anti-inflammatory, antiproliferative and antitumour effects. Triptolide is a NF-κB activation inhibitor[1][2][3][4][5][6]. Triptolide is a diterpenoid triepoxide extracted from the root of Tripterygium wilfordii with immunosuppressive, anti-inflammatory, antiproliferative and antitumour effects. Triptolide is a NF-κB activation inhibitor[1][2][3][4][5][6].
nitrendipine
C - Cardiovascular system > C08 - Calcium channel blockers > C08C - Selective calcium channel blockers with mainly vascular effects > C08CA - Dihydropyridine derivatives C78274 - Agent Affecting Cardiovascular System > C270 - Antihypertensive Agent > C333 - Calcium Channel Blocker D002317 - Cardiovascular Agents > D002121 - Calcium Channel Blockers D002317 - Cardiovascular Agents > D000959 - Antihypertensive Agents D002317 - Cardiovascular Agents > D014665 - Vasodilator Agents D000077264 - Calcium-Regulating Hormones and Agents D049990 - Membrane Transport Modulators C93038 - Cation Channel Blocker
Nadifloxacin
D - Dermatologicals > D10 - Anti-acne preparations > D10A - Anti-acne preparations for topical use > D10AF - Antiinfectives for treatment of acne D000970 - Antineoplastic Agents > D059003 - Topoisomerase Inhibitors > D059005 - Topoisomerase II Inhibitors D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D024841 - Fluoroquinolones C254 - Anti-Infective Agent > C258 - Antibiotic > C795 - Quinolone Antibiotic D004791 - Enzyme Inhibitors
7-methyl-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylic acid
1-(3,4-dihydroxy-5-methoxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one
2,5-bis(4-hydroxy-3-methoxyphenyl)-3,4-dimethyloxolan-3-ol
3-methoxy-4-[1-(3,4,5-trimethoxyphenyl)propan-2-yloxy]benzaldehyde
1,7-bis(3,4-dihydroxyphenyl)-6-methoxyheptan-3-one
2,5-bis(4-hydroxy-3-methoxyphenyl)-3,4-dimethyloxolan-3-ol
C16H24O9_beta-D-Glucopyranoside, 3-hydroxy-2-(4-hydroxy-3-methoxyphenyl)propyl
C20H24O6_(3aR,4S,6E,9Z,11aS)-4-Hydroxy-6,10-dimethyl-3-methylene-2,8-dioxo-2,3,3a,4,5,8,11,11a-octahydrocyclodeca[b]furan-11-yl (2Z)-2-methyl-2-butenoate
C20H24O6_2-Butenoic acid, 2-methyl-, (3aR,4R,5R,6E,9Z,11aR)-2,3,3a,4,5,8,11,11a-octahydro-4-hydroxy-6,10-dimethyl-3-methylene-2,8-dioxocyclodeca[b]furan-5-yl ester, (2Z)
(2R,3R,4S,5S,6R)-2-[3-hydroxy-2-(4-hydroxy-3-methoxyphenyl)propoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
7-methyl-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylic acid
2,5-bis(4-hydroxy-3-methoxyphenyl)-3,4-dimethyloxolan-3-ol [IIN-based on: CCMSLIB00000847949]
2,5-bis(4-hydroxy-3-methoxyphenyl)-3,4-dimethyloxolan-3-ol [IIN-based: Match]
3-methoxy-4-[1-(3,4,5-trimethoxyphenyl)propan-2-yloxy]benzaldehyde [IIN-based: Match]
3-methoxy-4-[1-(3,4,5-trimethoxyphenyl)propan-2-yloxy]benzaldehyde [IIN-based on: CCMSLIB00000846397]
[(3aR,4R,5R,6E,9Z,11aR)-4-hydroxy-6,10-dimethyl-3-methylidene-2,8-dioxo-4,5,11,11a-tetrahydro-3aH-cyclodeca[b]furan-5-yl] (Z)-2-methylbut-2-enoate_major
7-methyl-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylic acid_major
(2R,3R,4S,5S,6R)-2-[3-hydroxy-2-(4-hydroxy-3-methoxyphenyl)propoxy]-6-(hydroxymethyl)oxane-3,4,5-triol_major
Ala Ala Cys Pro
Ala Ala Pro Cys
Ala Cys Ala Pro
Ala Cys Pro Ala
Ala Pro Ala Cys
Ala Pro Cys Ala
Cys Ala Ala Pro
Cys Ala Pro Ala
Cys Pro Ala Ala
Gly Gly Met Pro
Gly Gly Asn Asn
Gly Gly Pro Met
Gly Met Gly Pro
Gly Met Pro Gly
Gly Asn Gly Asn
Gly Asn Asn Gly
Gly Pro Gly Met
Gly Pro Met Gly
Met Gly Gly Pro
Met Gly Pro Gly
Met Pro Gly Gly
Asn Gly Gly Asn
Asn Gly Asn Gly
Asn Asn Gly Gly
Pro Ala Ala Cys
Pro Ala Cys Ala
Pro Cys Ala Ala
Pro Gly Gly Met
Pro Gly Met Gly
Pro Met Gly Gly
1-(3,4-Dimethoxyphenyl)-1,2-ethanediol 1-O-b-D-glucoside
1-(3,4-Dimethoxyphenyl)-1,2-ethanediol 2-O-b-D-glucoside
Quassinol
2-(4-Hydroxy-3,5-dimethoxyphenyl)ethanol 4'-glucoside
Sparoxomycin A1
4-Acetylzearalenone
2'-Methoxy-3-(2,4-dihydroxyphenyl)-1,2-propanediol 4'-glucoside
3',4',5',7,8-Pentamethoxyflavan
2,5-Bis(4-hydroxy-3-methoxyphenyl)-3,4-dimethyltetrahydro-3-furanol
Lactose
COVID info from clinicaltrial, clinicaltrials, clinical trial, clinical trials Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS Pharmatose DCL 14 is an endogenous metabolite. α-Lactose (hydrate) (α-D-Lactose (hydrate)) is the principal carbohydrate in the milk of most mammals. α-Lactose (hydrate) consists of glucose and galactose and exists in the form of two anomers, α and β. α-Lactose (hydrate) has many uses in the food and pharmaceutical industries, such as a free-flowing or agglomerating agent, a diluent for pigments, flavors, or enzymes[1][2][3].
N-(5-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)PYRIDIN-3-YL)BENZENESULFONAMIDE
C17H21BN2O4S (360.1315016000001)
N-(5-ACETYL-2-METHYLPHENYL)-4-(PYRIDIN-2-YLMETHOXY)BENZAMIDE
(2S,3R,4S,5R,6R)-2-[[(2R,3S,4R)-4-hydroxy-2-(hydroxymethyl)-3,4-dihydro-2H-pyran-3-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol
6-O-ALPHA-D-GALACTOPYRANOSYL-D-GLUCOSE MONOHYDRATE
4-(4-METHYL-5-(2-(TRIFLUOROMETHYL)PHENYL)-4H-1,2,4-TRIAZOL-3-YL)BICYCLO[2.2.2]OCTANE-1-CARBONITRILE
C19H19F3N4 (360.15617299999997)
9,9-Spirobi[fluoren]-2-ylboronic acid
C25H17BO2 (360.13215319999995)
9,9-Spirobi[9H-fluoren]-4-ylboronic acid
C25H17BO2 (360.13215319999995)
L-Tyrosine, O-(5-(2-amino-2-carboxyethyl)-2-hydroxyphenyl)-
17-acetyl-6-chloro-17-hydroxy-10,13-dimethyl-9,11,12,14,15,16-hexahydro-8H-cyclopenta[a]phenanthren-3-one
C21H25ClO3 (360.14921300000003)
D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006727 - Hormone Antagonists > D000726 - Androgen Antagonists D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones > D011372 - Progestins
Levonadifloxacin
J - Antiinfectives for systemic use > J01 - Antibacterials for systemic use > J01M - Quinolone antibacterials > J01MA - Fluoroquinolones D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D065093 - beta-Lactamase Inhibitors D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D024841 - Fluoroquinolones C254 - Anti-Infective Agent > C258 - Antibiotic > C795 - Quinolone Antibiotic D004791 - Enzyme Inhibitors
(R)-nadifloxacin
D000970 - Antineoplastic Agents > D059003 - Topoisomerase Inhibitors > D059005 - Topoisomerase II Inhibitors D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D024841 - Fluoroquinolones D004791 - Enzyme Inhibitors
Benzamide, N-(4-(1-methyl-2-(((1-methylethyl)sulfonyl)amino)ethyl)phenyl)-
(4betaH)-5alpha-hydroxy-8alpha-(2-methylbut-2-enoyloxy)-2-oxo-1(10),11(13)-guaiadien-12,6alpha-olide
A guaiane sesquiterpenoid isolated from Elephantopus mollis and has been shown to exhibit cytotoxic activity.
6-(3-Aminophenyl)-N-(tert-butyl)-2-(trifluoromethyl)quinazolin-4-amine
C19H19F3N4 (360.15617299999997)
2-Amino-3-[4-[2-hydroxy-5-(2-amino-3-oxo-3-hydroxypropyl)phenoxy]phenyl]propionic acid
7-(3,4-Dihydroxyphenyl)-1-(3-methoxy-4,5-dihydroxyphenyl)heptane-3-one
2,2'-Bityrosine
(3R,4R)-3,4-bis(4-hydroxy-3-methoxybenzyl)tetrahydro-2-furanol
(1R,2S,3S,4S,5S,8R,9R,12R)-8-formyl-5-hydroxy-4-methyl-13-methylidenetetracyclo[10.2.1.01,9.03,8]pentadecane-2,4-dicarboxylate
Triptolide, from Tripterygium wilfordii, >=98\\% (HPLC), solid
D012102 - Reproductive Control Agents > D003270 - Contraceptive Agents D007155 - Immunologic Factors > D007166 - Immunosuppressive Agents D009676 - Noxae > D000988 - Antispermatogenic Agents D009676 - Noxae > D000477 - Alkylating Agents D000970 - Antineoplastic Agents
3-(diethylsulfamoyl)-N-(3,5-dimethylphenyl)benzamide
N-[4-[[2-[1-(2-methoxyethyl)-2,5-dimethyl-3-pyrrolyl]-2-oxoethyl]thio]phenyl]acetamide
2-Amino-3-[(3-methoxyphenyl)hydrazinylidene]-5-phenyl-7-pyrazolo[1,5-a]pyrimidinone
C19H16N6O2 (360.13346759999996)
3,4-dihydro-2H-quinolin-1-yl-(7-methoxy-4,5-dihydrobenzo[g][1,2]benzoxazol-3-yl)methanone
4,5-Dimethoxy-2-[[(2-methoxyanilino)-oxomethyl]amino]benzoic acid methyl ester
(1S)-N-(4-fluorophenyl)-6,7-dimethoxy-1-methyl-3,4-dihydro-1H-isoquinoline-2-carbothioamide
N-cyclobutyl-2-[[2-(4-ethoxyphenyl)-5-methyl-4-oxazolyl]methylthio]acetamide
N-cyclopropyl-2-[[5-methyl-2-(4-propoxyphenyl)-4-oxazolyl]methylthio]acetamide
3-O-ethyl 5-O-methyl 2,6-dimethyl-4-(3-nitrophenyl)-3,4-dihydropyridine-3,5-dicarboxylate
7-Deoxyloganic acid
A cyclopentapyran that is 1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylic acid substituted at positions 1 and 7 by beta-D-glucosyloxy and methyl groups respectively (the 1S,4aS,7S,7aR-diatereomer).
Ethyl 2-chloro-3-[4-(2-methyl-2-phenylpropoxy)phenyl]propanoate
C21H25ClO3 (360.14921300000003)
2-(4-Hydroxy-3,5-dimethoxyphenyl)ethanol 4-glucoside
2-Methoxy-3-(2,4-dihydroxyphenyl)-1,2-propanediol 4-glucoside
TD52
TD52, an Erlotinib (HY-50896) derivative, is an orally active, potent cancerous inhibitor of protein phosphatase 2A (CIP2A) inhibitor. TD52 mediates the apoptotic effect in triple-negative breast cancer (TNBC) cells via regulating the CIP2A/PP2A/p-Akt signalling pathway. TD52 indirectly reduced CIP2A by disturbing Elk1 binding to the CIP2A promoter. TD52 has less p-EGFR inhibition and has potent anti-cancer activity[1]. TD52 is a click chemistry reagent, it contains an Alkyne group and can undergo copper-catalyzed azide-alkyne cycloaddition (CuAAc) with molecules containing Azide groups.
(1r,4as,7s,7as)-4a-hydroxy-7-methyl-1-{[(2r,3s,4r,5r,6s)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,5h,6h,7h,7ah-cyclopenta[c]pyran-4-carbaldehyde
3-(hydroxymethyl)-4-[(2e)-1-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}but-2-en-2-yl]-5,6-dihydropyran-2-one
3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl 5-hydroxy-7-methyl-1h,4ah,5h,6h,7h,7ah-cyclopenta[c]pyran-4-carboxylate
(1s,4as,5r,7s,7ar)-5-hydroxy-7-methyl-1-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,4ah,5h,6h,7h,7ah-cyclopenta[c]pyran-4-carbaldehyde
(2s,3s,4r,5r,6s)-2-[(2r)-2-(3,4-dimethoxyphenyl)-2-hydroxyethoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
2,3,4,5,6-pentahydroxyhexyl 2,4-dimethoxy-6-methylbenzoate
6-methyl-5-({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)-3h,4h,5h,6h,8h-pyrano[3,4-c]pyran-1-one
(1r,4ar,7r,7ar)-7-hydroxy-7-methyl-1-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,4ah,5h,6h,7ah-cyclopenta[c]pyran-4-carbaldehyde
(1s,4as,6s,7s,7as)-6-hydroxy-7-methyl-1-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,4ah,5h,6h,7h,7ah-cyclopenta[c]pyran-4-carbaldehyde
(2s,4e)-4-[(2e)-2-{[2-(4-hydroxy-3-methoxyphenyl)ethyl]imino}ethylidene]-2,3-dihydro-1h-pyridine-2,6-dicarboxylic acid
1'-(4-hydroxy-2-methoxyphenyl)propane-2',3-diol 4-o-β-d-glucopyranoside
{"Ingredient_id": "HBIN001463","Ingredient_name": "1'-(4-hydroxy-2-methoxyphenyl)propane-2',3-diol 4-o-\u03b2-d-glucopyranoside","Alias": "NA","Ingredient_formula": "C16H24O9","Ingredient_Smile": "COC1=C(C=CC(=C1)OC2C(C(C(C(O2)CO)O)O)O)CC(CO)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "10432","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
1- hydroxy- 7- hydroxymethyl- 1,4a,5,7a- tetrahydrocyclopenta［c］pyran- 4- carb Aldehyde
{"Ingredient_id": "HBIN002642","Ingredient_name": "1- hydroxy- 7- hydroxymethyl- 1,4a,5,7a- tetrahydrocyclopenta\uff3bc\uff3dpyran- 4- carb Aldehyde","Alias": "NA","Ingredient_formula": "C16H24O9","Ingredient_Smile": "CC1(CCC2C1C(OC=C2C=O)OC3C(C(C(C(O3)CO)O)O)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "43007","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
2,6-dimethoxy-4-(2-hydroxyethyl)phenol1-o-β-d-glucopyranoside
{"Ingredient_id": "HBIN004891","Ingredient_name": "2,6-dimethoxy-4-(2-hydroxyethyl)phenol1-o-\u03b2-d-glucopyranoside","Alias": "NA","Ingredient_formula": "C16H24O9","Ingredient_Smile": "CC1CCC2(C1C(OC=C2C=O)OC3C(C(C(C(O3)CO)O)O)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "6238","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
methyl (13e)-13-ethylidene-17-formyl-3,18-diazapentacyclo[10.6.1.0²,¹⁰.0⁴,⁹.0¹⁴,¹⁸]nonadeca-2(10),4,6,8,14,16-hexaene-11-carboxylate
methyl (1r,11r,12s,13z)-13-ethylidene-17-formyl-3,18-diazapentacyclo[10.6.1.0²,¹⁰.0⁴,⁹.0¹⁴,¹⁸]nonadeca-2(10),4,6,8,14,16-hexaene-11-carboxylate
(2r,3s,4s,5r,6r)-2-(hydroxymethyl)-6-[(3,4,5-trimethoxyphenyl)methoxy]oxane-3,4,5-triol
14-ethyl-9-oxo-8,16-diazahexacyclo[11.5.2.1¹,⁸.0²,⁷.0¹⁶,¹⁹.0¹²,²¹]henicosa-2,4,6,10,12(21),14-hexaene-10-carboxylic acid
(3r)-1-(furan-3-yl)-3-hydroxy-4-methyl-4-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}pentan-1-one
4a-hydroxy-7-methyl-1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,5h,6h,7h,7ah-cyclopenta[c]pyran-4-carbaldehyde
2-(hydroxymethyl)-6-{[7-(hydroxymethyl)-5-methoxy-1h,4ah,5h,7ah-cyclopenta[c]pyran-1-yl]oxy}oxane-3,4,5-triol
(1s,2r,4ar,5r,8r,8as)-5-bromo-8-hydroxy-2-isopropyl-4a,8-dimethyl-octahydronaphthalen-1-yl acetate
(4as,5r,6s,8ar)-5-ethenyl-6-{[(2s,3s,4r,5r,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-hexahydro-3h-pyrano[3,4-c]pyran-1-one
methyl (2s,4r,5s,6s)-6-[3-(cyanomethyl)-4-methoxyindol-1-yl]-4,5-dihydroxyoxane-2-carboxylate
dimethyl(2-{9-methyl-6-thia-4,9,19-triazapentacyclo[10.7.1.0³,⁷.0⁸,²⁰.0¹³,¹⁸]icosa-1(19),2,4,7,10,12(20),13,15,17-nonaen-2-yl}ethyl)amine
C21H20N4S (360.14086000000003)