Exact Mass: 442.1257
Exact Mass Matches: 442.1257
Found 500 metabolites which its exact mass value is equals to given mass value 442.1257
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Cortisol 21-sulfate
Cortisol 21-sulfate is also known as Cortisol-21-sulfuric acid or 4-Pregnen-11,17,21-triol-3,20-dione 21-sulfate. Cortisol 21-sulfate is considered to be practically insoluble (in water) and acidic. Cortisol 21-sulfate is a steroid conjugate lipid molecule D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones
12-Dehydrotetracycline
The 12-dehydro derivative of tetracycline.
Methacycline
Methacycline is only found in individuals that have used or taken this drug. It is a broad-spectrum semisynthetic antibiotic related to tetracycline but excreted more slowly and maintaining effective blood levels for a more extended period. [PubChem]Methacycline, a tetracycline antibiotic, is a protein synthesis inhibitors, inhibiting the binding of aminoacyl-tRNA to the mRNA-ribosome complex. Methacycline inhibits cell growth by inhibiting translation. It binds to the 16S part of the 30S ribosomal subunit and prevents the amino-acyl tRNA from binding to the A site of the ribosome. The binding is reversible in nature. Tetracyclines also have been found to inhibit matrix metalloproteinases. This mechanism does not add to their antibiotic effects, but has led to extensive research on chemically modified tetracyclines or CMTs (like incyclinide) for the treatmet of rosacea, acne, and various types of neoplasms. J - Antiinfectives for systemic use > J01 - Antibacterials for systemic use > J01A - Tetracyclines > J01AA - Tetracyclines C784 - Protein Synthesis Inhibitor > C1595 - Tetracycline Antibiotic D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents C254 - Anti-Infective Agent > C258 - Antibiotic
Eltrombopag
B - Blood and blood forming organs > B02 - Antihemorrhagics > B02B - Vitamin k and other hemostatics COVID info from clinicaltrial, clinicaltrials, clinical trial, clinical trials C78275 - Agent Affecting Blood or Body Fluid Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS
(-)-Epicatechin 3-O-gallate
(-)-epicatechin-3-O-gallate is a gallate ester obtained by formal condensation of the carboxy group of gallic acid with the (3R)-hydroxy group of epicatechin. A natural product found in Parapiptadenia rigida. It has a role as a metabolite, an EC 3.2.1.1 (alpha-amylase) inhibitor and an EC 3.2.1.20 (alpha-glucosidase) inhibitor. It is a catechin, a gallate ester and a polyphenol. It is functionally related to a (-)-epicatechin and a gallic acid. (-)-Epicatechin gallate is a natural product found in Scurrula atropurpurea, Acacia omalophylla, and other organisms with data available. Isolated from tea and numerous other plant subspecies inc. rhubarb and grapes. Epicatechin 3-gallate is found in many foods, some of which are cucumber, muskmelon, black raspberry, and cashew nut. A gallate ester obtained by formal condensation of the carboxy group of gallic acid with the (3R)-hydroxy group of epicatechin. A natural product found in Parapiptadenia rigida. (-)-Epicatechin 3-O-gallate is found in almond. (-)-Epicatechin 3-O-gallate is isolated from tea and numerous other plant species including rhubarb and grapes. D004791 - Enzyme Inhibitors > D011480 - Protease Inhibitors D020011 - Protective Agents > D000975 - Antioxidants D000970 - Antineoplastic Agents (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM. (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM. (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM. (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM.
(-)-Catechin 3-O-gallate
(-)-catechin-3-O-gallate is a gallate ester obtained by formal condensation of the carboxy group of gallic acid with the (3R)-hydroxy group of (-)-catechin. It has a role as a metabolite. It is a gallate ester, a polyphenol and a member of flavans. It is functionally related to a (-)-catechin and a gallic acid. It is an enantiomer of a (+)-catechin-3-O-gallate. (-)-Catechin gallate is a natural product found in Rheum palmatum, Vitis vinifera, and other organisms with data available. A gallate ester obtained by formal condensation of the carboxy group of gallic acid with the (3R)-hydroxy group of (-)-catechin. (-)-Catechin 3-O-gallate is a polyphenol compound found in foods of plant origin (PMID: 20428313) (-)-Catechin gallate is a minor constituent in green tea catechins. (-)-Catechin gallate inhibits the activity of COX-1 and COX-2 enzymes. (-)-Catechin gallate is a minor constituent in green tea catechins. (-)-Catechin gallate inhibits the activity of COX-1 and COX-2 enzymes. (-)-Catechin gallate is a minor constituent in green tea catechins. (-)-Catechin gallate inhibits the activity of COX-1 and COX-2 enzymes. (-)-Catechin gallate is a minor constituent in green tea catechins. (-)-Catechin gallate inhibits the activity of COX-1 and COX-2 enzymes.
7-Galloylcatechin
7-Galloylcatechin is found in herbs and spices. 7-Galloylcatechin is isolated from roots of great burnet (Sanguisorba officinalis). Isolated from roots of great burnet (Sanguisorba officinalis). Catechin 7-gallate is found in tea and herbs and spices.
1-O-E-Cinnamoyl-(6-arabinosylglucose)
1-O-E-Cinnamoyl-(6-arabinosylglucose) is found in fruits. 1-O-E-Cinnamoyl-(6-arabinosylglucose) is a constituent of Psidium guajava (guava)
[2-(3,4-dihydroxyphenyl)-3,7-dihydroxy-3,4-dihydro-2H-chromen-5-yl] 3,4,5-trihydroxybenzoate
3-Galloylcatechin
Constituent of Bergenia crassifolia (Siberian tea). Catechin 3-gallate is found in many foods, some of which are macadamia nut (m. tetraphylla), tea, avocado, and pecan nut. 3-Galloylcatechin is found in almond. 3-Galloylcatechin is a constituent of Bergenia crassifolia (Siberian tea) (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM. (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM. (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM. (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM.
beta-D-Xylopyranosyl-(1->4)-alpha-L-rhamnopyranosyl-(1->2)-D-fucose
beta-D-Xylopyranosyl-(1->4)-alpha-L-rhamnopyranosyl-(1->2)-D-fucose is a constituent of desacylsaponins from the bark of Quillaja saponaria (soapbark tree). Constituent of desacylsaponins from the bark of Quillaja saponaria (soap-bark tree)
Epicatechin-3-gallate
Eltrombopag
B - Blood and blood forming organs > B02 - Antihemorrhagics > B02B - Vitamin k and other hemostatics COVID info from clinicaltrial, clinicaltrials, clinical trial, clinical trials C78275 - Agent Affecting Blood or Body Fluid Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS
Indanthrene
Rondomycin
Piflufolastat F 18
Antibiotic RP 1551-3
Pratensin A
Epicatechin-3-gallate
(-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM. (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM. (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM. (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM.
(-)-Catechin gallate
(-)-Catechin gallate is a minor constituent in green tea catechins. (-)-Catechin gallate inhibits the activity of COX-1 and COX-2 enzymes. (-)-Catechin gallate is a minor constituent in green tea catechins. (-)-Catechin gallate inhibits the activity of COX-1 and COX-2 enzymes. (-)-Catechin gallate is a minor constituent in green tea catechins. (-)-Catechin gallate inhibits the activity of COX-1 and COX-2 enzymes. (-)-Catechin gallate is a minor constituent in green tea catechins. (-)-Catechin gallate inhibits the activity of COX-1 and COX-2 enzymes.
Regaloside B
Regaloside B is a natural product found in Lilium auratum and Lilium brownii with data available. Regaloside B is a phenylpropanoid isolated from Lilium longiflorum. Regaloside B can inhibit the expression of iNOS and COX-2. Regaloside B has anti-inflammatory activity[1][2]. Regaloside B is a phenylpropanoid isolated from Lilium longiflorum. Regaloside B can inhibit the expression of iNOS and COX-2. Regaloside B has anti-inflammatory activity[1][2].
(+)-Catechin 4-O-gallate|4-O-(3,4,5-Trihydroxybenzoyl)-(2R,3S)-3,3,4,5,7-Pentahydroxyflavan
8a-[4-(alpha-rhamnopyranosyl)-2-oxo-2,5-dihydro-furan-3-ylmethyl]-6-methyl-tetrahydro-furo[3,4-c]oxepine-1,8-dione
2,2-diamino-4,4-dioxo-4,4-(2-amino-3-oxo-3H-phenoxazine-1,9-diyl)-bis-butyric acid
(+)-phrymarin II|1-acetoxy-2e-piperonyl-6e-[6-methoxypiperonyl]-3,7-dioxabicyclo[3.3.0]octane
(-)-sanguinolignan C|(8S,7S,8R)-7-acetoxy-3,4-methylenedioxy-3,4-dimethoxy-7-oxolignano-9,9-lactone
2,3-Dimethoxy-14,15-dihydroxy-16,16-dimethyl-9,10-(epoxypropano)-5,11,13-trioxa-5H-benzo[4,5]cyclohepta[1,2-b]naphthalene-6(12H)-one
7,8-dihydroxy-6-[3-beta-D-glucopyranosyloxy-2(zeta)-hydroxy-3-methylbutyl]coumarin|skimminan
Dienestrol glucuronide|O1-[alpha,alpha-Di-((E)-aethyliden)-4-hydroxy-bibenzyl-4-yl]-beta-D-glucopyranuronsaeure|O1-[alpha,alpha-di-((E)-ethylidene)-4-hydroxy-bibenzyl-4-yl]-beta-D-glucopyranuronic acid
8-(4-Hydroxyphenylactyl),Me ester-6,8,15-Trihydroxy-2-oxo-1(10),3,11(13)-guaiatrien-12-oic acid|Methyl 2-oxo-6alpha,15-dihydroxy-8alpha-(p-hydroxyphenylacetoxy)-guaia-1(10),3,11-trien-5alphaH-12-oate
(-)-(1R*,2S*,3S*,4S*,5R*,6R*)-2-O-acetyl-4-O-benzoyl-1-benzoyloxymethyl-1,6-epoxycyclohexan-2,3,4,5-tetrol|2-acetylrotepoxide B
7-O-Galloyltricetiflavan
A gallate ester obtained by the formal condensation of gallic acid with the hydroxy group at position 7 of 3,4,5,5,7-pentahydroxyflavan. Isolated from the leaves of Pithecellobium clypearia, it exhibits antiviral activity.
4-((6-O-caffeoyl-beta-D-glucopyranosyl)oxy)-2-methylbutyric acid
2-(3,4-Dimethoxyphenyl)-3,5-dimethoxy-7-(2-hydroxy-3-methyl-3-butenyloxy)-4H-1-benzopyran-4-one
BENZYL 2,3-DI-O-ACETYL-4,6-O-BENZYLIDEN-|A-D-GLUCOPYRANOSIDE
2-acetyl-3-[(E)-caffeoyl]-1-[(E)-p-coumaroyl]glycerol|Lasiocarpin B
Mulberrofuran H
Mulberrofuran H is a natural product found in Morus lhou, Morus mongolica, and Morus alba with data available.
O-alpha-L-rhamnopyranosyl-(1-2)-O-alpha-L-rhamnopyranosyl-(1-5)-L-arabinose
5-O-trans-cinnamoyl beta-D-apiosyl(1->3)-alpha-D-glucopyranoside|visartiside D
2-amino-5-[[1-(carboxymethylamino)-3-[(4-nitrophenyl)methylsulfanyl]-1-oxopropan-2-yl]amino]-5-oxopentanoic acid
RubioncolinC
Rubioncolin C is a natural product found in Rubia oncotricha with data available.
Rubipodanone A
Rubipodanone A, a naphthohydroquinone dimer, shows cytotoxicity against A549, BEL-7402, HeLa, HepG2, SGC-7901 and U251 cells. Rubipodanone A also shows obvious activating effect at 20 and 40 μM for NF-κB[1].
Yadanziolide B
Yadanziolide B is a quassinoid that is 13,20-epoxypicras-3-ene substituted by hydroxy groups at positions 1, 6, 11, 12, 14, 15 and 21 and oxo groups at positions 2 and 16. Isolated from the ethanol extract of the stem of Brucea mollis, it exhibits cytotoxic activity. It has a role as an antineoplastic agent and a plant metabolite. It is a quassinoid, a delta-lactone, an enone, an organic heteropentacyclic compound, a heptol and a secondary alpha-hydroxy ketone. It derives from a hydride of a picrasane. Yadanziolide B is a natural product found in Brucea javanica and Brucea mollis with data available. A quassinoid that is 13,20-epoxypicras-3-ene substituted by hydroxy groups at positions 1, 6, 11, 12, 14, 15 and 21 and oxo groups at positions 2 and 16. Isolated from the ethanol extract of the stem of Brucea mollis, it exhibits cytotoxic activity.
Pasakbumin D
Pasakbumin D is a natural product found in Eurycoma longifolia with data available.
catechin gallate
(-)-Catechin gallate is a minor constituent in green tea catechins. (-)-Catechin gallate inhibits the activity of COX-1 and COX-2 enzymes. (-)-Catechin gallate is a minor constituent in green tea catechins. (-)-Catechin gallate inhibits the activity of COX-1 and COX-2 enzymes. (-)-Catechin gallate is a minor constituent in green tea catechins. (-)-Catechin gallate inhibits the activity of COX-1 and COX-2 enzymes. (-)-Catechin gallate is a minor constituent in green tea catechins. (-)-Catechin gallate inhibits the activity of COX-1 and COX-2 enzymes.
[(2R,3R)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3,4-dihydro-2H-chromen-3-yl] 3,4,5-trihydroxybenzoate
[(2S,3R)-2-(3,4-dihydroxyphenyl)-3,5-dihydroxy-3,4-dihydro-2H-chromen-7-yl] 3,4,5-trihydroxybenzoate
(-)-Epicatechin gallate
(-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM. (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM. (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM. (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM.
C24H26O8_Spiro[furo[4,3,2-ij]pyrano[4,3:4,5]cyclohepta[1,2-f][2]benzopyran-7(9H),2-oxirane]-1,5,9,13(2H,3aH,11H)-tetrone, 5a,6,6a,13a,13b,13c-hexahydro-2,5a,11,11,13a-pentamethyl
epicatechin gallate
(-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM. (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM. (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM. (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM.
[(2S,3R)-2-(3,4-dihydroxyphenyl)-3,5-dihydroxy-3,4-dihydro-2H-chromen-7-yl] 3,4,5-trihydroxybenzoate
epicatechin monogallate
(-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM. (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM. (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM. (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM.
[(2S,3R)-2-(3,4-dihydroxyphenyl)-3,5-dihydroxy-3,4-dihydro-2H-chromen-7-yl] 3,4,5-trihydroxybenzoate [IIN-based on: CCMSLIB00000848607]
[(2S,3R)-2-(3,4-dihydroxyphenyl)-3,5-dihydroxy-3,4-dihydro-2H-chromen-7-yl] 3,4,5-trihydroxybenzoate [IIN-based: Match]
Ala Cys Cys Phe
Ala Cys Phe Cys
Ala Cys Ser Tyr
Ala Cys Tyr Ser
Ala Phe Cys Cys
Ala Ser Cys Tyr
Ala Ser Tyr Cys
Ala Tyr Cys Ser
Ala Tyr Ser Cys
Cys Ala Cys Phe
Cys Ala Phe Cys
Cys Ala Ser Tyr
Cys Ala Tyr Ser
Cys Cys Ala Phe
Cys Cys Phe Ala
Cys Cys Met Ser
Cys Cys Ser Met
Cys Phe Ala Cys
Cys Phe Cys Ala
Cys Phe Ser Ser
Cys Gly Thr Tyr
Cys Gly Tyr Thr
Cys His Pro Ser
Cys His Ser Pro
Cys Met Cys Ser
Cys Met Ser Cys
Cys Pro His Ser
Cys Pro Ser His
Cys Ser Ala Tyr
Cys Ser Cys Met
Cys Ser Phe Ser
Cys Ser His Pro
Cys Ser Met Cys
Cys Ser Pro His
Cys Ser Ser Phe
Cys Ser Tyr Ala
Cys Thr Gly Tyr
Cys Thr Tyr Gly
Cys Tyr Ala Ser
Cys Tyr Gly Thr
Cys Tyr Ser Ala
Cys Tyr Thr Gly
Asp Asp Gly His
Asp Asp His Gly
Asp Gly Asp His
Asp Gly His Asp
Asp His Asp Gly
Asp His Gly Asp
Mometasone Metabolite (Pregna-1,4-diene-3,20-dione, 9,21-dichloro-6,11,17-trihydroxy-16-methyl-, (6b
Mometasone Metabolite (Pregna-1,4-diene-3,20-dione, 9,21-dichloro-6,11,17-trihydroxy-16-methyl-, (6a
Phe Ala Cys Cys
Phe Cys Ala Cys
Phe Cys Cys Ala
Phe Cys Ser Ser
Phe Ser Cys Ser
Phe Ser Ser Cys
Gly Cys Thr Tyr
Gly Cys Tyr Thr
Gly Asp Asp His
Gly Asp His Asp
Gly His Asp Asp
Gly Thr Cys Tyr
Gly Thr Tyr Cys
Gly Tyr Cys Thr
Gly Tyr Thr Cys
His Cys Pro Ser
His Cys Ser Pro
His Asp Asp Gly
His Asp Gly Asp
His Gly Asp Asp
His Pro Cys Ser
His Pro Ser Cys
His Ser Cys Pro
His Ser Pro Cys
Met Cys Cys Ser
Met Cys Ser Cys
Met Ser Cys Cys
Pro Cys His Ser
Pro Cys Ser His
Pro His Cys Ser
Pro His Ser Cys
Pro Ser Cys His
Pro Ser His Cys
Ser Ala Cys Tyr
Ser Ala Tyr Cys
Ser Cys Ala Tyr
Ser Cys Cys Met
Ser Cys Phe Ser
Ser Cys His Pro
Ser Cys Met Cys
Ser Cys Pro His
Ser Cys Ser Phe
Ser Cys Tyr Ala
Ser Phe Cys Ser
Ser Phe Ser Cys
Ser His Cys Pro
Ser His Pro Cys
Ser Met Cys Cys
Ser Pro Cys His
Ser Pro His Cys
Ser Ser Cys Phe
Ser Ser Phe Cys
Ser Tyr Ala Cys
Ser Tyr Cys Ala
Thr Cys Gly Tyr
Thr Cys Tyr Gly
Thr Gly Cys Tyr
Thr Gly Tyr Cys
Thr Tyr Cys Gly
Thr Tyr Gly Cys
Tyr Ala Cys Ser
Tyr Ala Ser Cys
Tyr Cys Ala Ser
Tyr Cys Gly Thr
Tyr Cys Ser Ala
Tyr Cys Thr Gly
Tyr Gly Cys Thr
Tyr Gly Thr Cys
Tyr Ser Ala Cys
Tyr Ser Cys Ala
Tyr Thr Cys Gly
Tyr Thr Gly Cys
methacycline
J - Antiinfectives for systemic use > J01 - Antibacterials for systemic use > J01A - Tetracyclines > J01AA - Tetracyclines A tetracycline that is the 6-methylene analogue of oxytetracycline, obtained by formal dehydration at position 6. C784 - Protein Synthesis Inhibitor > C1595 - Tetracycline Antibiotic D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents C254 - Anti-Infective Agent > C258 - Antibiotic
1-O-E-Cinnamoyl-(6-arabinosylglucose)
Icosyl palmitate
b-D-Xylopyranosyl-(1->4)-a-L-rhamnopyranosyl-(1->2)-D-fucose
ST 21:3;O5;S
D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones
acetyl 4-[6-(4-acetyloxycarbonylphenoxy)hexoxy]benzoate
7-Amino-8-oxo-3-(cis-prop-1-enyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid diphenylmethyl ester hydrochloride
(1S,2S)-1,2-Bis(4-dimethylaminophenyl)-1,2-ethanediamine tetrahydrochloride
2-benzofuran-1,3-dione,ethane-1,2-diol,furan-2,5-dione,3-(3-hydroxypropoxy)propan-1-ol
Benzo[1,2-b:4,5-b]dithiophene, 2,6-bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)
Acepromazine maleate
D002492 - Central Nervous System Depressants > D014149 - Tranquilizing Agents > D014150 - Antipsychotic Agents D002491 - Central Nervous System Agents > D011619 - Psychotropic Drugs > D014149 - Tranquilizing Agents D018377 - Neurotransmitter Agents > D015259 - Dopamine Agents > D018492 - Dopamine Antagonists D002491 - Central Nervous System Agents > D002492 - Central Nervous System Depressants C78272 - Agent Affecting Nervous System > C66883 - Dopamine Antagonist
(-)-1,1-bis((2s,4s)-2,4-diethylphosphotano)ferrocene
2,2-dimethylpropane-1,3-diol,1,3-dioxo-2-benzofuran-5-carboxylic acid,hexanedioic acid
(s)-1-[(1r)-2-(diphenylphosphino)ferrocenyl]ethyldi-tert-butylphosphine
6-chloro-3-indolyl-beta-d-glucuronide cyclohexylammonium salt
Zuclopenthixol acetate
D002492 - Central Nervous System Depressants > D014149 - Tranquilizing Agents > D014150 - Antipsychotic Agents D002491 - Central Nervous System Agents > D011619 - Psychotropic Drugs > D014149 - Tranquilizing Agents D002491 - Central Nervous System Agents > D002492 - Central Nervous System Depressants C78272 - Agent Affecting Nervous System > C29710 - Antipsychotic Agent
Telenzepine dihydrochloride
Telenzepine dihydrochloride is a selective and orally active muscarinic M1 receptor antagonist with a Ki of 0.94 nM. Telenzepine dihydrochloride inhibits gastric acid secretion and has antiulcer effects[1][2][3].
4-(4,6-dicyano-2-ethoxynaphthalen-1-yl)-3-ethoxynaphthalene-1,7-dicarbonitrile
lithium 1-amino-9,10-dihydro-9,10-dioxo-4-[(2,4,6-trimethylphenyl)amino]anthracene-2-sulphonate
Methyl 2-oxo-3-{[2-(5-oxo-2,5-dihydro-1,2,4-oxadiazol-3-yl)-4-biphenylyl]methyl}-2,3-dihydro-1H-benzimidazole-4-carboxylate
N-[(11bS)-4,5-Dihydro-3H-dinaphtho[2,1-c:1,2-e]azepin-2-yl]trifluoromethanesulfonamide
(3aR,4R,5R,6aS)- 5-(benzoyloxy)-4-[(1E,3S)-4-(3-chlorophenoxy)-3-hydroxy-1-buten-1-yl]hexahydro-2H-Cyclopenta[b]furan-2-one
(5R,6S)-4-NITROBENZYL 3-((2-AMINOETHYL)THIO)-6-((R)-1-HYDROXYETHYL)-7-OXO-1-AZABICYCLO[3.2.0]HEPT-2-ENE-2-CARBOXYLATE HYDROCHLORIDE
Piflufolastat F-18
V - Various > V09 - Diagnostic radiopharmaceuticals > V09I - Tumour detection C1446 - Radiopharmaceutical Compound > C2124 - Radioconjugate
5-(5-(3-(Trifluoromethyl)-4-(((2S)-1,1,1-trifluoropropan-2-yl)oxy)phenyl)-1,2,4-oxadiazol-3-yl)-1H-benzimidazole
BRL 15572 hydrochloride
D018377 - Neurotransmitter Agents > D018490 - Serotonin Agents > D012702 - Serotonin Antagonists
(-)-Epicatechin-5-gallate
A gallate ester resulting from the formal condensation of gallic acid with 5-hydroxy group of (-)-epicatechin. Isolated from Orostachys japonica, it acts as an inhibitor of the enzyme mu-calpain (EC 3.4.22.52).
(1-Tert-Butyl-5-Hydroxy-1h-Pyrazol-4-Yl)[6-(Methylsulfonyl)-4-Methoxy-2-Methyl-1,1-Biphenyl-3-Yl]methanone
N-{2,4-Difluoro-3-[(5-Pyridin-3-Yl-1h-Pyrrolo[2,3-B]pyridin-3-Yl)carbonyl]phenyl}ethanesulfonamide
863-03-6
D004791 - Enzyme Inhibitors > D011480 - Protease Inhibitors D020011 - Protective Agents > D000975 - Antioxidants D000970 - Antineoplastic Agents (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM. (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM. (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM. (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM.
E3893_SIAL
D004791 - Enzyme Inhibitors > D011480 - Protease Inhibitors D020011 - Protective Agents > D000975 - Antioxidants D000970 - Antineoplastic Agents (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM. (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM. (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM. (-)-Epicatechin gallate (Epicatechin gallate) inhibits cyclooxygenase-1 (COX-1) with an IC50 of 7.5 μM.
(E)-2-(4-(3-(2-Chloro-9H-thioxanthen-9-ylidene)propyl)piperazin-1-YL)ethyl acetate
(4S,4aR,5S,5aR,12aR)-4-(dimethylamino)-5,10,11,12a-tetrahydroxy-6-methylidene-1,3,12-trioxo-4,4a,5,5a-tetrahydrotetracene-2-carboxamide
(-)-sanguinolignan C
A lignan isolated from the leaves of Piper sanguineispicum.
3-(2-chlorophenyl)-6-[4-methoxy-3-(3-oxolanyloxy)phenyl]-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
2-[(chloroacetyl)(4-methoxyphenyl)amino]-N-(2-phenylethyl)-2-thien-2-ylacetamide
(6-Bromo-5-methoxy-2-methyl-3-benzofuranyl)-[4-(2-methylphenyl)-1-piperazinyl]methanone
2-[(chloroacetyl)(3-methoxyphenyl)amino]-N-(2-phenylethyl)-2-thien-2-ylacetamide
4-methyl-N-(2-phenylphenyl)-3-(phenylsulfamoyl)benzamide
N-(3,4-dimethylphenyl)-2-[N-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonyl]-4-methoxyanilino]acetamide
N-(3-methoxyphenyl)-1-[4-(1-tetrazolyl)phenyl]sulfonyl-3-piperidinecarboxamide
2-[[2-[4-(4-Chlorophenyl)-1-piperazinyl]-2-oxoethyl]thio]-3-ethyl-4-quinazolinone
2-[(3-ethyl-7-methyl-4-oxo-6,8-dihydro-5H-pyrido[2,3]thieno[2,4-b]pyrimidin-2-yl)thio]-N-(2-phenylethyl)acetamide
4-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[[2-(2-pyridinyl)-1-benzimidazolyl]methyl]-1H-1,2,4-triazole-5-thione
3-[[[[3-[(4-Chlorophenyl)methyl]-2-methyl-4-oxo-6-quinazolinyl]amino]-oxomethyl]amino]propanoic acid ethyl ester
1-Butyl-2-[(5-phenyl-2-oxazolyl)methylthio]-5-benzimidazolesulfonamide
3-[(4-methyl-1-piperazinyl)sulfonyl]-N-(4-phenyl-2-thiazolyl)benzamide
[4-methoxy-3-(4-morpholinylsulfonyl)phenyl]-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)methanone
1-(4-Chlorophenyl)-5-[[4-(4-morpholinyl)anilino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
N-[2-(cyclopentylamino)-1-(5-methyl-2-furanyl)-2-oxoethyl]-N-[(4-fluorophenyl)methyl]-4-thiadiazolecarboxamide
[1-(2,1,3-Benzothiadiazol-4-ylsulfonyl)-3-piperidinyl]-(2-methyl-2,3-dihydroindol-1-yl)methanone
[5-(2-Furanyl)-7-(trifluoromethyl)-2-pyrazolo[1,5-a]pyrimidinyl]-[4-(2-pyridinyl)-1-piperazinyl]methanone
2-Amino-5-oxo-4-phenyl-1-[3-(trifluoromethyl)phenyl]-4,6,7,8-tetrahydroquinoline-3-carboxylic acid methyl ester
2-[2-chloro-4-(methylsulfonyl)-3-{[(2R)-tetrahydrofuran-2-ylmethoxy]methyl}benzoyl]cyclohexane-1,3-dione
[4-[Bis(4-fluorophenyl)methyl]-1-piperazinyl]-(5-methyl-4-nitro-3-isoxazolyl)methanone
(1R,5S)-6-(4-chlorophenyl)sulfonyl-7-[4-(3-fluorophenyl)phenyl]-3,6-diazabicyclo[3.1.1]heptane
methyl (1S,3R)-2-(chloroacetyl)-1-[4-(methoxycarbonyl)phenyl]-2,3,4,4a,9,9a-hexahydro-1H-beta-carboline-3-carboxylate
2-chloro-N-[(2R,3R,6R)-2-(hydroxymethyl)-6-[2-(4-propyl-1-triazolyl)ethyl]-3-oxanyl]benzenesulfonamide
2-chloro-N-[(2S,3S,6S)-2-(hydroxymethyl)-6-[2-(4-propyl-1-triazolyl)ethyl]-3-oxanyl]benzenesulfonamide
2-chloro-N-[(2S,3R,6S)-2-(hydroxymethyl)-6-[2-(4-propyl-1-triazolyl)ethyl]-3-oxanyl]benzenesulfonamide
2-chloro-N-[(2R,3S,6R)-2-(hydroxymethyl)-6-[2-(4-propyl-1-triazolyl)ethyl]-3-oxanyl]benzenesulfonamide
2-chloro-N-[(2S,3R,6R)-2-(hydroxymethyl)-6-[2-(4-propyl-1-triazolyl)ethyl]-3-oxanyl]benzenesulfonamide
2-chloro-N-[(2S,3S,6R)-2-(hydroxymethyl)-6-[2-(4-propyl-1-triazolyl)ethyl]-3-oxanyl]benzenesulfonamide
2-chloro-N-[(2R,3S,6S)-2-(hydroxymethyl)-6-[2-(4-propyl-1-triazolyl)ethyl]-3-oxanyl]benzenesulfonamide
2-chloro-N-[(2R,3R,6S)-2-(hydroxymethyl)-6-[2-(4-propyl-1-triazolyl)ethyl]-3-oxanyl]benzenesulfonamide
2-[2-chloro-4-(methylsulfonyl)-3-{[(2S)-tetrahydrofuran-2-ylmethoxy]methyl}benzoyl]cyclohexane-1,3-dione
6-[2-[4,6-Dihydroxy-2-methoxy-3-(3-methylbut-2-enyl)phenyl]acetyl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
6-[6-[(2-Carboxyacetyl)oxymethyl]-2,4,5-trihydroxyoxan-3-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
1-[(Z)-(1-acetyl-6-hydroxyspiro[3H-chromene-2,4-piperidine]-4-ylidene)amino]-3-(2-fluorophenyl)thiourea
2-[2-(2,5-difluoroanilino)-2-hydroxyethyl]sulfanyl-3-ethyl-7-phenyl-5H-pyrrolo[3,2-d]pyrimidin-4-one
[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] (3R)-3-isocyanobutanoate
3-[(4aS,12aR)-2-methyl-1,3,4,5,12,12a-hexahydropyrido[3,4-b]acridin-4a-yl]phenol;hydrate;hydrobromide
15-(1,3-Dihydroxy-3-methylbutyl)-4,18-dihydroxy-2-methoxy-7,9,13-trioxapentacyclo[10.8.0.03,10.04,8.014,19]icosa-1,3(10),5,11,14,16,18-heptaen-20-one
(4R,4aR,5R,5aR,12aR)-4-(dimethylamino)-1,5,10,11,12a-pentahydroxy-6-methylidene-3,12-dioxo-4,4a,5,5a-tetrahydrotetracene-2-carboxamide
11,17-Dihydroxy-3,20-dioxopregn-4-en-21-yl hydrogen sulfate
D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones
cortisol 21-sulfate
A steroid sulfate obtained by the formal condensation of hydroxy group at position 21 of cortisol with sulfuric acid. D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones
epicatechin-3-gallate
D004791 - Enzyme Inhibitors > D011480 - Protease Inhibitors D020011 - Protective Agents > D000975 - Antioxidants D000970 - Antineoplastic Agents
S-adenosyl-S-carboxymethyl-L-homocysteine dizwitterion
A sulfonium betaine obtained by deprotonation of the carboxy groups and protonation of the amino group of S-adenosyl-S-carboxymethyl-L-homocysteine. Major microspecies at pH 7.3
12-dehydrotetracycline zwitterion
Zwitterionic form of 12-dehydrotetracycline arising from transfer of a proton from the 2-hydroxy group to the adjacent tertiary amino group.
(+)-epicatechin-3-O-gallate
A gallate ester obtained by formal condensation of the carboxy group of gallic acid with the (3S)-hydroxy group of (+)-epicatechin.
(+)-catechin-3-O-gallate
A gallate ester obtained by formal condensation of the carboxy group of gallic acid with the (3S)-hydroxy group of (+)-catechin.
PF-739
PF-739 is an orally active and non-selective activator of AMPK. PF-739 activates 12 heterotrimeric AMPK complexes and significantly reduces the level of glucose in plasma complexes[1][2].
2,3,7,12,15,16-hexahydroxy-17-(hydroxymethyl)-9,13-dimethyl-5,18-dioxapentacyclo[12.5.0.0¹,⁶.0²,¹⁷.0⁸,¹³]nonadec-9-ene-4,11-dione
(2s,3r,4s,5s,6r)-6-({[(2s,3r,4r,5r)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-3,4,5-trihydroxyoxan-2-yl (2e)-3-phenylprop-2-enoate
2-({4,5-dihydroxy-6-methyl-2-[(3,4,5-trihydroxyoxolan-2-yl)methoxy]oxan-3-yl}oxy)-6-methyloxane-3,4,5-triol
4-{4-[4-(acetyloxy)-3-methoxyphenyl]-hexahydrofuro[3,4-c]furan-1-yl}-2-methoxyphenyl acetate
18,19-dimethoxy-13,14-dimethyl-20-oxo-3,6,8-trioxapentacyclo[9.9.1.0¹,¹⁶.0⁴,²¹.0⁵,⁹]henicosa-4,9,11(21),16,18-pentaen-12-yl acetate
3,4,5-trihydroxy-6-{[(3,4,5-trihydroxyoxan-2-yl)oxy]methyl}oxan-2-yl 3-phenylprop-2-enoate
(2s)-4-hydroxy-3-methylidene-1-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}butan-2-yl (2e)-3-(3,4-dihydroxyphenyl)prop-2-enoate
(2s,3r,4r,5r,6s)-2-{[(2r,3r,4r,5r,6s)-4,5-dihydroxy-6-methyl-2-{[(2s,3r,4r,5s)-3,4,5-trihydroxyoxolan-2-yl]methoxy}oxan-3-yl]oxy}-6-methyloxane-3,4,5-triol
2-[(5-heptyl-7-hydroxy-4-oxochromen-2-yl)methyl]-3,4,6-trihydroxybenzoic acid
6-({[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-3,4,5-trihydroxyoxan-2-yl 3-phenylprop-2-enoate
5-(6-hydroxy-1-benzofuran-2-yl)-2-{5-hydroxy-9-methyl-8-oxatricyclo[7.3.1.0²,⁷]trideca-2,4,6,10-tetraen-11-yl}benzene-1,3-diol
5,7-dihydroxy-3,6-dimethoxy-2-(4-methoxyphenyl)-4-oxochromen-8-yl 2-methylbut-2-enoate
(2s)-1-(acetyloxy)-3-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}propan-2-yl (2e)-3-(4-hydroxyphenyl)prop-2-enoate
3- o -galloyl- ent -catechin
{"Ingredient_id": "HBIN009326","Ingredient_name": "3- o -galloyl- ent -catechin","Alias": "NA","Ingredient_formula": "C22H18O10","Ingredient_Smile": "NA","Ingredient_weight": "442.378","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "8512","PubChem_id": "NA","DrugBank_id": "NA"}
acetoxyl oxokadsurane
{"Ingredient_id": "HBIN014435","Ingredient_name": "acetoxyl oxokadsurane","Alias": "NA","Ingredient_formula": "C24H26O8","Ingredient_Smile": "CC1CC2=CC(=C(C(=O)C23COC4=C3C(=CC5=C4OCO5)C(C1C)OC(=O)C)OC)OC","Ingredient_weight": "442.5 g/mol","OB_score": "28.59565179","CAS_id": "NA","SymMap_id": "SMIT11596","TCMID_id": "NA","TCMSP_id": "MOL010567","TCM_ID_id": "NA","PubChem_id": "49770118","DrugBank_id": "NA"}