Exact Mass: 442.142
Exact Mass Matches: 442.142
Found 500 metabolites which its exact mass value is equals to given mass value 442.142
,
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
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)
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)
3-[(2R)-2-Hydroxy-3-methyl-3-[(phosphonooxy)methyl]butanamido]propanoylcarnitine
3-[(2R)-2-Hydroxy-3-methyl-3-[(phosphonooxy)methyl]butanamido]propanoylcarnitine is an acylcarnitine. More specifically, it is an 3-[(2R)-2-hydroxy-3-methyl-3-[(phosphonooxy)methyl]butanamido]propanoic acid ester of carnitine. Acylcarnitines were first discovered more than 70 year ago (PMID: 13825279). It is believed that there are more than 1000 types of acylcarnitines in the human body. The general role of acylcarnitines is to transport acyl-groups (organic acids and fatty acids) from the cytoplasm into the mitochondria so that they can be broken down to produce energy. This process is known as beta-oxidation. According to a recent review [Dambrova et al. 2021, Physiological Reviews], acylcarnitines (ACs) can be classified into 9 different categories depending on the type and size of their acyl-group: 1) short-chain ACs; 2) medium-chain ACs; 3) long-chain ACs; 4) very long-chain ACs; 5) hydroxy ACs; 6) branched chain ACs; 7) unsaturated ACs; 8) dicarboxylic ACs and 9) miscellaneous ACs. Short-chain ACs have acyl-groups with two to five carbons (C2-C5), medium-chain ACs have acyl-groups with six to thirteen carbons (C6-C13), long-chain ACs have acyl-groups with fourteen to twenty once carbons (C14-C21) and very long-chain ACs have acyl groups with more than 22 carbons. 3-[(2R)-2-Hydroxy-3-methyl-3-[(phosphonooxy)methyl]butanamido]propanoylcarnitine is therefore classified as a medium chain AC. As a medium-chain acylcarnitine 3-[(2R)-2-Hydroxy-3-methyl-3-[(phosphonooxy)methyl]butanamido]propanoylcarnitine is somewhat less abundant than short-chain acylcarnitines. These are formed either through esterification with L-carnitine or through the peroxisomal metabolism of longer chain acylcarnitines (PMID: 30540494). Many medium-chain acylcarnitines can serve as useful markers for inherited disorders of fatty acid metabolism. Carnitine octanoyltransferase (CrOT, EC:2.3.1.137) is responsible for the synthesis of all medium-chain (MCAC, C5-C12) and medium-length branched-chain acylcarnitines in peroxisomes (PMID: 10486279). The study of acylcarnitines is an active area of research and it is likely that many novel acylcarnitines will be discovered in the coming years. It is also likely that many novel roles in health and disease will be uncovered. An excellent review of the current state of knowledge for acylcarnitines is available at [Dambrova et al. 2021, Physiological Reviews].
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
Hydrocortisone phosphate
Rondomycin
Piflufolastat F 18
Antibiotic RP 1551-3
Pratensin A
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].
16,19-Secostrychnidine-10,16-dione, 21,22-epoxy-21,22-dihydro-4,14-dihydroxy-3-methoxy-19-methyl-, (21.alpha.,22.alpha.)-
(1S,3R,5S,6S,8S,9S,10R,13R)-1-acetoxy-3-bromo-6-hydroxy-8,13-epoxylabd-14-ene
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
3beta,4alpha-dihydroxy-4-beta-(chloromethyl)-8alpha-(4-hydroxymethacrylate)-11beta,13-dihydro-13-isopropyl-1alphaH,5alphaH,6betaH,7alphaH-guai-10(14)-en-6,12-olide|Diain
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
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.
3,4,17-trihydroxy-6,7-didehydro-aspidofractinine-1,3-dicarboxylic acid dimethyl ester|ent-(2S)-3alpha,4xi,17-Trihydroxy-6,7-didehydro-aspidofractinin-1,3beta-dicarbonsaeure-dimethylester|ent-(2S)-3alpha,4xi,17-trihydroxy-6,7-didehydro-aspidofractinine-1,3beta-dicarboxylic acid dimethyl ester|Kopsaporin
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.
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
Ala Cys Cys Phe
Ala Cys Phe Cys
Ala Cys Ser Tyr
Ala Cys Tyr Ser
Ala Asp His Thr
Ala Asp Thr His
Ala Glu His Ser
Ala Glu Ser His
Ala Phe Cys Cys
Ala His Asp Thr
Ala His Glu Ser
Ala His Ser Glu
Ala His Thr Asp
Ala Ser Cys Tyr
Ala Ser Glu His
Ala Ser His Glu
Ala Ser Tyr Cys
Ala Thr Asp His
Ala Thr His Asp
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 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 Pro His Ser
Cys Pro Ser His
Cys Ser Ala Tyr
Cys Ser Phe Ser
Cys Ser His Pro
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 Ala His Thr
Asp Ala Thr His
Asp Asp Gly His
Asp Asp His Gly
Asp Asp Pro Pro
Asp Gly Asp His
Asp Gly His Asp
Asp His Ala Thr
Asp His Asp Gly
Asp His Gly Asp
Asp His Thr Ala
Asp Pro Asp Pro
Asp Pro Pro Asp
Asp Thr Ala His
Asp Thr His Ala
Glu Ala His Ser
Glu Ala Ser His
Glu Gly His Thr
Glu Gly Thr His
Glu His Ala Ser
Glu His Gly Thr
Glu His Ser Ala
Glu His Thr Gly
Glu Ser Ala His
Glu Ser His Ala
Glu Thr Gly His
Glu Thr His Gly
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 Glu His Thr
Gly Glu Thr His
Gly His Asp Asp
Gly His Glu Thr
Gly His Thr Glu
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
Pro Cys His Ser
Pro Cys Ser His
Pro Asp Asp Pro
Pro Asp Pro Asp
Pro His Cys Ser
Pro His Ser Cys
Pro Pro Asp Asp
Pro Ser Cys His
Pro Ser His Cys
Ser Ala Cys Tyr
Ser Ala Tyr Cys
Ser Cys Ala Tyr
Ser Cys Phe Ser
Ser Cys His Pro
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 Pro Cys His
Ser Pro His Cys
Ser Ser Cys Phe
Ser Ser Phe Cys
Ser Ser Ser Tyr
Ser Ser Tyr Ser
Ser Tyr Ala Cys
Ser Tyr Cys Ala
Ser Tyr Ser Ser
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 Ser Ser Ser
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
Hydrocortisone phosphate
C147908 - Hormone Therapy Agent > C548 - Therapeutic Hormone > C1636 - Therapeutic Steroid Hormone C308 - Immunotherapeutic Agent > C574 - Immunosuppressant > C211 - Therapeutic Corticosteroid D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones
1-O-E-Cinnamoyl-(6-arabinosylglucose)
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
1-Boc-4-[4-(3,4-dichlorophenoxy)piperidin-1-ylmethyl]piperidine
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
2-[4-[(4-ethoxyphenyl)methylamino]phenyl]-1-ethylbenz[cd]indolium chloride
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
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
(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
Piflufolastat F-18
V - Various > V09 - Diagnostic radiopharmaceuticals > V09I - Tumour detection C1446 - Radiopharmaceutical Compound > C2124 - Radioconjugate
BRL 15572 hydrochloride
D018377 - Neurotransmitter Agents > D018490 - Serotonin Agents > D012702 - Serotonin Antagonists
(1-Tert-Butyl-5-Hydroxy-1h-Pyrazol-4-Yl)[6-(Methylsulfonyl)-4-Methoxy-2-Methyl-1,1-Biphenyl-3-Yl]methanone
3-[(2R)-2-Hydroxy-3-methyl-3-[(phosphonooxy)methyl]butanamido]propanoylcarnitine
(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.
2-[(chloroacetyl)(4-methoxyphenyl)amino]-N-(2-phenylethyl)-2-thien-2-ylacetamide
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
N-[2-(cyclopentylamino)-1-(5-methyl-2-furanyl)-2-oxoethyl]-N-[(4-fluorophenyl)methyl]-4-thiadiazolecarboxamide
8-[(1-tert-butyl-5-tetrazolyl)-thiomorpholin-4-ylmethyl]-3,6-dihydro-2H-[1,4]dioxino[2,3-g]quinolin-7-one
[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-[(11S,17R)-11,17-dihydroxy-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl] dihydrogen phosphate
[4-[Bis(4-fluorophenyl)methyl]-1-piperazinyl]-(5-methyl-4-nitro-3-isoxazolyl)methanone
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
N-[(1R,3R,4aR,9aS)-1-(hydroxymethyl)-3-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-6-yl]-2-cyclopropylacetamide
N-[(1S,3R,4aS,9aR)-1-(hydroxymethyl)-3-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-6-yl]-2-cyclopropylacetamide
N-[(1R,3S,4aS,9aR)-1-(hydroxymethyl)-3-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-6-yl]-2-cyclopropylacetamide
[(3aS,4S,9bR)-8-[2-(2-fluorophenyl)ethynyl]-4-(hydroxymethyl)-5-methyl-3,3a,4,9b-tetrahydro-2H-pyrrolo[3,2-c]quinolin-1-yl]-(2-pyrazinyl)methanone
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
N-[(1S,3S,4aS,9aR)-1-(hydroxymethyl)-3-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-6-yl]-2-cyclopropylacetamide
N-[(1R,3R,4aS,9aR)-1-(hydroxymethyl)-3-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-6-yl]-2-cyclopropylacetamide
N-[(1S,3S,4aR,9aS)-1-(hydroxymethyl)-3-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-6-yl]-2-cyclopropylacetamide
N-[(1S,3R,4aR,9aS)-1-(hydroxymethyl)-3-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-6-yl]-2-cyclopropylacetamide
6-[2-[4,6-Dihydroxy-2-methoxy-3-(3-methylbut-2-enyl)phenyl]acetyl]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
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
methyl (1R,9S,10R,11R,17S)-14-ethenyl-13-(2-hydroxyacetyl)oxy-12,21-dioxa-8,18-diazahexacyclo[9.9.1.01,9.02,7.09,17.010,15]henicosa-2,4,6-triene-10-carboxylate
(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
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.
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
23-hydroxy-17,18-dimethoxy-7,10-dioxa-4,14-diazaheptacyclo[10.8.3.2¹¹,¹⁴.0¹,¹³.0⁶,⁸.0⁶,²³.0¹⁵,²⁰]pentacosa-15(20),16,18-triene-21,24-dione
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
2-[2-(4-{2-hydroxy-5-[2-(3-hydroxyphenyl)ethyl]phenoxy}phenyl)ethyl]benzene-1,4-diol
(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-{3-[3-(3-hydroxy-5-methylphenoxy)-5-methylphenoxy]-5-methylphenoxy}-5-methylphenol
5-[2-(3-hydroxyphenyl)ethyl]-3-{4-[2-(3-hydroxyphenyl)ethyl]phenoxy}benzene-1,2-diol
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"}