Exact Mass: 496.2155806
Exact Mass Matches: 496.2155806
Found 500 metabolites which its exact mass value is equals to given mass value 496.2155806
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Glaucarubin
Glaucarubin is found in fats and oils. Glaucarubin is isolated from Simarouba glauca (aceituno C254 - Anti-Infective Agent > C276 - Antiparasitic Agent > C277 - Antiprotozoal Agent Isolated from Simarouba glauca (aceituno). Glaucarubin is found in fats and oils. D000970 - Antineoplastic Agents
7alpha-1(10->19)-Abeo-7-acetoxyobacun-9(11)-ene
7alpha-1(10->19)-Abeo-7-acetoxyobacun-9(11)-ene is found in citrus. 7alpha-1(10->19)-Abeo-7-acetoxyobacun-9(11)-ene is a constituent of the fruits of a Citrus-Poncirus hybrid Constituent of the fruits of a Citrus-Poncirus hybrid. 7alpha-1(10->19)-Abeo-7-acetoxyobacun-9(11)-ene is found in citrus.
Atractyligenin 2-glucuronide
Betamethasone 17-benzoate
Selexipag
B - Blood and blood forming organs > B01 - Antithrombotic agents > B01A - Antithrombotic agents > B01AC - Platelet aggregation inhibitors excl. heparin D002317 - Cardiovascular Agents > D000959 - Antihypertensive Agents C78568 - Prostaglandin Analogue
(1R,4S,7R,8S)-7-[(2E,4E)-hexa-2,4-dienoyl]-3-hydroxy-8-[(2S)-3-hydroxy-2,4-dimethyl-5-oxo-2,5-dihydrofuran-2-yl]-5-[(2E,4E)-1-hydroxyhexa-2,4-dien-1-ylidene]-1,3-dimethylbicyclo[2.2.2]octane-2,6-dione
4alpha-hydroxy-1beta,5alpha,11alphaH-guaian-10(14)-ene-12,8beta-olide-<2,6-O-diacetyl-beta-D-glucopyranoside>
trichodimerol
An organic heterotetracyclic compound found in Trichoderma longibrachiatum and Penicillium chrysogenum.
1,3,7,10-tetrahydroxy-8,8-dimethyl-4,11-bis(3-methyl-2-buten-1-yl)-6,7-dihydro-8H,13H-[1,4]benzodioxepino[2,3-d]benzopyran-13-one|oliveridepsidone B
3alpha-(2-hydroxy-3-acetoxy-2-methylbutyryloxy)-4alpha-acetoxy-8beta-methoxy-7(11)-eudesmen-12,8-olide
(+)-arisugacin A|(4aR,6aR,12aR,12bS)-4a,6,6a,12,12a,12b-hexahydro-4a,12alpha-dihydroxy-4,4,6a,12b-tetramethyl-9-(3,4-dimethoxyphenyl)-4H,11H-naphtho[2,1-b]pyrano[3,4-e]pyran-1,11(5H)-dione|Arisugacin|arisugacin A
Tyr Ser Val Glu
C28H32O8_(2E,4E,2E,4E)-1,1-[(1R,7S,10S)-1,6,8,13-Tetrahydroxy-3,7,10,14-tetramethyl-2,9-dioxapentacyclo[8.4.0.0~3,8~.0~4,14~.0~7,11~]tetradeca-5,12-diene-5,12-diyl]bis(2,4-hexadien-1-one)
(2E,4E)-1-[(1R,3S,8R,10S,14S)-12-[(2E,4E)-hexa-2,4-dienoyl]-1,6,8,13-tetrahydroxy-3,7,10,14-tetramethyl-2,9-dioxapentacyclo[8.4.0.0³,⁸.0⁴,¹⁴.0⁷,¹¹]tetradeca-5,12-dien-5-yl]hexa-2,4-dien-1-one
(1R,4S,7R,8S)-7-[(2E,4E)-hexa-2,4-dienoyl]-3-hydroxy-8-[(2S)-3-hydroxy-2,4-dimethyl-5-oxo-2,5-dihydrofuran-2-yl]-5-[(2E,4E)-1-hydroxyhexa-2,4-dien-1-ylidene]-1,3-dimethylbicyclo[2.2.2]octane-2,6-dione_major
(2E,4E)-1-[(1R,3S,8R,10S,14S)-12-[(2E,4E)-hexa-2,4-dienoyl]-1,6,8,13-tetrahydroxy-3,7,10,14-tetramethyl-2,9-dioxapentacyclo[8.4.0.0³,⁸.0⁴,¹⁴.0⁷,¹¹]tetradeca-5,12-dien-5-yl]hexa-2,4-dien-1-one_major
(2E,4E)-1-[(1R,3S,8R,10S,14S)-12-[(2E,4E)-hexa-2,4-dienoyl]-1,6,8,13-tetrahydroxy-3,7,10,14-tetramethyl-2,9-dioxapentacyclo[8.4.0.0³,?.0?,¹?.0?,¹¹]tetradeca-5,12-dien-5-yl]hexa-2,4-dien-1-one
Ala Glu Phe Met
Ala Glu Met Phe
Ala Phe Glu Met
Ala Phe Met Glu
Ala Phe Pro Tyr
Ala Phe Tyr Pro
Ala Met Glu Phe
Ala Met Phe Glu
Ala Pro Phe Tyr
Ala Pro Tyr Phe
Ala Tyr Phe Pro
Ala Tyr Pro Phe
Cys Asp Phe Ile
Cys Asp Phe Leu
Cys Asp Ile Phe
Cys Asp Leu Phe
Cys Glu Phe Val
Cys Glu Val Phe
Cys Phe Asp Ile
Cys Phe Asp Leu
Cys Phe Glu Val
Cys Phe Ile Asp
Cys Phe Leu Asp
Cys Phe Val Glu
Cys Ile Asp Phe
Cys Ile Phe Asp
Cys Leu Asp Phe
Cys Leu Phe Asp
Cys Val Glu Phe
Cys Val Phe Glu
Asp Cys Phe Ile
Asp Cys Phe Leu
Asp Cys Ile Phe
Asp Cys Leu Phe
Asp Phe Cys Ile
Asp Phe Cys Leu
Asp Phe Ile Cys
Asp Phe Leu Cys
Asp Ile Cys Phe
Asp Ile Phe Cys
Asp Ile Ser Tyr
Asp Ile Tyr Ser
Asp Leu Cys Phe
Asp Leu Phe Cys
Asp Leu Ser Tyr
Asp Leu Tyr Ser
Asp Ser Ile Tyr
Asp Ser Leu Tyr
Asp Ser Tyr Ile
Asp Ser Tyr Leu
Asp Thr Val Tyr
Asp Thr Tyr Val
Asp Val Thr Tyr
Asp Val Tyr Thr
Asp Tyr Ile Ser
Asp Tyr Leu Ser
Asp Tyr Ser Ile
Asp Tyr Ser Leu
Asp Tyr Thr Val
Asp Tyr Val Thr
Glu Ala Phe Met
Glu Ala Met Phe
Glu Cys Phe Val
Glu Cys Val Phe
Glu Phe Ala Met
Glu Phe Cys Val
Glu Phe Met Ala
Glu Phe Thr Thr
Glu Phe Val Cys
Glu Met Ala Phe
Glu Met Phe Ala
Glu Ser Val Tyr
Glu Ser Tyr Val
Glu Thr Phe Thr
Glu Thr Thr Phe
Glu Val Cys Phe
Glu Val Phe Cys
Glu Val Ser Tyr
Glu Val Tyr Ser
Glu Tyr Ser Val
Glu Tyr Val Ser
Phe Ala Glu Met
Phe Ala Met Glu
Phe Ala Pro Tyr
Phe Ala Tyr Pro
Phe Cys Asp Ile
Phe Cys Asp Leu
Phe Cys Glu Val
Phe Cys Ile Asp
Phe Cys Leu Asp
Phe Cys Val Glu
Phe Asp Cys Ile
Phe Asp Cys Leu
Phe Asp Ile Cys
Phe Asp Leu Cys
Phe Glu Ala Met
Phe Glu Cys Val
Phe Glu Met Ala
Phe Glu Thr Thr
Phe Glu Val Cys
Phe Phe Pro Ser
Phe Phe Ser Pro
Phe Gly His His
Phe His Gly His
Phe His His Gly
Phe Ile Cys Asp
Phe Ile Asp Cys
Phe Leu Cys Asp
Phe Leu Asp Cys
Phe Met Ala Glu
Phe Met Glu Ala
Phe Met Val Thr
Phe Pro Ala Tyr
Phe Pro Phe Ser
Phe Pro Ser Phe
Phe Pro Tyr Ala
Phe Ser Phe Pro
Phe Ser Ile Met
Phe Ser Leu Met
Phe Ser Met Ile
Phe Ser Met Leu
Phe Ser Pro Phe
Phe Thr Glu Thr
Phe Thr Met Val
Phe Thr Thr Glu
Phe Thr Val Met
Phe Val Cys Glu
Phe Val Glu Cys
Phe Val Met Thr
Phe Val Thr Met
Phe Tyr Ala Pro
Phe Tyr Pro Ala
Gly Phe His His
Gly His Phe His
Gly His His Phe
His Phe Gly His
His Phe His Gly
His Gly Phe His
His Gly His Phe
His His Phe Gly
His His Gly Phe
Ile Ala Met Tyr
Ile Ala Tyr Met
Ile Cys Asp Phe
Ile Cys Phe Asp
Ile Cys Val Tyr
Ile Cys Tyr Val
Ile Asp Cys Phe
Ile Asp Phe Cys
Ile Asp Ser Tyr
Ile Asp Tyr Ser
Ile Phe Cys Asp
Ile Phe Asp Cys
Ile Phe Met Ser
Ile Phe Ser Met
Ile Met Ala Tyr
Ile Met Phe Ser
Ile Met Ser Phe
Ile Met Tyr Ala
Ile Ser Asp Tyr
Ile Ser Phe Met
Ile Ser Met Phe
Ile Ser Tyr Asp
Ile Val Cys Tyr
Ile Val Tyr Cys
Ile Tyr Ala Met
Ile Tyr Cys Val
Ile Tyr Asp Ser
Ile Tyr Met Ala
Ile Tyr Ser Asp
Ile Tyr Val Cys
Leu Ala Met Tyr
Leu Ala Tyr Met
Leu Cys Asp Phe
Leu Cys Phe Asp
Leu Cys Val Tyr
Leu Cys Tyr Val
Leu Asp Cys Phe
Leu Asp Phe Cys
Leu Asp Ser Tyr
Leu Asp Tyr Ser
Leu Phe Cys Asp
Leu Phe Asp Cys
Leu Phe Met Ser
Leu Phe Ser Met
Leu Met Ala Tyr
Leu Met Phe Ser
Leu Met Ser Phe
Leu Met Tyr Ala
Leu Ser Asp Tyr
Leu Ser Phe Met
Leu Ser Met Phe
Leu Ser Tyr Asp
Leu Val Cys Tyr
Leu Val Tyr Cys
Leu Tyr Ala Met
Leu Tyr Cys Val
Leu Tyr Asp Ser
Leu Tyr Met Ala
Leu Tyr Ser Asp
Leu Tyr Val Cys
Met Ala Glu Phe
Met Ala Phe Glu
Met Ala Ile Tyr
Met Ala Leu Tyr
Met Ala Tyr Ile
Met Ala Tyr Leu
Met Glu Ala Phe
Met Glu Phe Ala
Met Phe Ala Glu
Met Phe Glu Ala
Met Phe Ile Ser
Met Phe Leu Ser
Met Phe Ser Ile
Met Phe Ser Leu
Met Pro Ser Tyr
Met Pro Tyr Ser
Met Ser Pro Tyr
Met Ser Tyr Pro
Met Tyr Pro Ser
Met Tyr Ser Pro
Pro Ala Phe Tyr
Pro Ala Tyr Phe
Pro Phe Ala Tyr
Pro Phe Phe Ser
Pro Phe Ser Phe
Pro Phe Tyr Ala
Pro Met Ser Tyr
Pro Met Tyr Ser
Pro Ser Phe Phe
Pro Ser Met Tyr
Pro Ser Tyr Met
Pro Tyr Ala Phe
Pro Tyr Phe Ala
Pro Tyr Met Ser
Pro Tyr Ser Met
Ser Asp Ile Tyr
Ser Asp Leu Tyr
Ser Asp Tyr Ile
Ser Asp Tyr Leu
Ser Glu Val Tyr
Ser Glu Tyr Val
Ser Phe Phe Pro
Ser Phe Pro Phe
Ser Ile Asp Tyr
Ser Ile Tyr Asp
Ser Leu Asp Tyr
Ser Leu Tyr Asp
Ser Met Pro Tyr
Ser Met Tyr Pro
Ser Pro Phe Phe
Ser Pro Met Tyr
Ser Pro Tyr Met
Ser Val Glu Tyr
Ser Val Tyr Glu
Ser Tyr Asp Ile
Ser Tyr Asp Leu
Ser Tyr Glu Val
Ser Tyr Ile Asp
Ser Tyr Leu Asp
Ser Tyr Met Pro
Ser Tyr Pro Met
Ser Tyr Val Glu
Thr Asp Val Tyr
Thr Asp Tyr Val
Thr Glu Phe Thr
Thr Glu Thr Phe
Thr Phe Glu Thr
Thr Phe Thr Glu
Thr Thr Glu Phe
Thr Thr Phe Glu
Thr Val Asp Tyr
Thr Val Tyr Asp
Thr Tyr Asp Val
Thr Tyr Val Asp
Val Cys Glu Phe
Val Cys Phe Glu
Val Asp Thr Tyr
Val Asp Tyr Thr
Val Glu Cys Phe
Val Glu Phe Cys
Val Glu Ser Tyr
Val Glu Tyr Ser
Val Phe Cys Glu
Val Phe Glu Cys
Val Ser Glu Tyr
Val Ser Tyr Glu
Val Thr Asp Tyr
Val Thr Tyr Asp
Val Tyr Asp Thr
Val Tyr Glu Ser
Val Tyr Ser Glu
Val Tyr Thr Asp
Tyr Ala Phe Pro
Tyr Ala Pro Phe
Tyr Asp Ile Ser
Tyr Asp Leu Ser
Tyr Asp Ser Ile
Tyr Asp Ser Leu
Tyr Asp Thr Val
Tyr Asp Val Thr
Tyr Glu Ser Val
Tyr Glu Val Ser
Tyr Phe Ala Pro
Tyr Phe Pro Ala
Tyr Ile Asp Ser
Tyr Ile Ser Asp
Tyr Leu Asp Ser
Tyr Leu Ser Asp
Tyr Met Pro Ser
Tyr Met Ser Pro
Tyr Pro Ala Phe
Tyr Pro Phe Ala
Tyr Pro Met Ser
Tyr Pro Ser Met
Tyr Ser Asp Ile
Tyr Ser Asp Leu
Tyr Ser Glu Val
Tyr Ser Ile Asp
Tyr Ser Leu Asp
Tyr Ser Met Pro
Tyr Ser Pro Met
Tyr Thr Asp Val
Tyr Thr Val Asp
Tyr Val Asp Thr
Tyr Val Glu Ser
Tyr Val Ser Glu
Tyr Val Thr Asp
7alpha-1(10->19)-Abeo-7-acetoxyobacun-9(11)-ene
EI-1625-2
An epoxide isolated from Streptomyces sp. E-1625. An inhibitor of interleukin-1beta converting enzyme (ICE), it acts as an anti-inflammatory agent and antibiotic.
Acutifolactone
Methylprednisolone Sodium Succinate
C26H33NaO8 (496.20730180000004)
D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones > D005938 - Glucocorticoids C147908 - Hormone Therapy Agent > C548 - Therapeutic Hormone > C1636 - Therapeutic Steroid Hormone C308 - Immunotherapeutic Agent > C574 - Immunosuppressant > C211 - Therapeutic Corticosteroid COVID info from clinicaltrial, clinicaltrials, clinical trial, clinical trials D002491 - Central Nervous System Agents > D018696 - Neuroprotective Agents D000893 - Anti-Inflammatory Agents D000970 - Antineoplastic Agents D020011 - Protective Agents Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS
Betamethasone benzoate
D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones > D005938 - Glucocorticoids C147908 - Hormone Therapy Agent > C548 - Therapeutic Hormone > C1636 - Therapeutic Steroid Hormone C308 - Immunotherapeutic Agent > C574 - Immunosuppressant > C211 - Therapeutic Corticosteroid D000893 - Anti-Inflammatory Agents
Arisugacin A
An organic heterotetracyclic compound that is 4a,12a-dihydroxy-4,4,6a,12b-tetramethyl-4a,6,6a,12,12a,12b-hexahydro-4H,11H-benzo[f]pyrano[4,3-b]chromene-1,11(5H)-dione substituted by 3,4-dimethoxyphenyl group at position 9 (the 4aR,6aR,12aS,12bS steroisomer). Isolated from the culture broth of Penicillium, it acts as a selective inhibitor of acetylcholinesterase.
Isodrummondin D
A chromenol that is a derivative of filicinic acid and is isolated from the stems and leaves of Hypericum drummondii. It has been found to exhibit antibacterial activity against Gram-positive bacteria Staphylococcus aureus and Bacillus subtilis and the acid fast bacterium Mycobacterium smegmatis.
Drummondin D
A chromenol that is a derivative of filicinic acid and is isolated from the stems and leaves of Hypericum drummondii. It has been found to exhibit antibacterial activity against Gram-positive bacteria Staphylococcus aureus and Bacillus subtilis and the acid fast bacterium Mycobacterium smegmatis.
(2R)-2-[[(2S)-4-methyl-2-[5-(6-oxo-3H-purin-9-yl)pentoxycarbonylamino]pentanoyl]amino]-3-methylsulfanylpropanoic acid
(1R,4S,5Z,7R,8S)-7-[(2E,4E)-hexa-2,4-dienoyl]-3-hydroxy-8-[(2S)-3-hydroxy-2,4-dimethyl-5-oxofuran-2-yl]-5-[(2E,4E)-1-hydroxyhexa-2,4-dienylidene]-1,3-dimethylbicyclo[2.2.2]octane-2,6-dione
Selexipag
B - Blood and blood forming organs > B01 - Antithrombotic agents > B01A - Antithrombotic agents > B01AC - Platelet aggregation inhibitors excl. heparin D002317 - Cardiovascular Agents > D000959 - Antihypertensive Agents C78568 - Prostaglandin Analogue
2-[({[4-({1-[5-(4-Methoxyphenyl)-1,3,4-oxadiazole-2-yl}oxy)phenyl]methyl}(methyl)amino)methyl]-2-methylpropane-1,3-diol
Atractyligenin 2-glucuronide
A diterpene glycoside that is atractyligenin having a single beta-D-glucuronic acid residue attached at position 2.
(1S,3R,4R,6E,7R,8S,10R,11R,13E,14R)-3,10-dihydroxy-6,13-bis[(2E,4E)-1-hydroxyhexa-2,4-dienylidene]-1,4,8,11-tetramethyl-2,9-dioxapentacyclo[8.4.0.03,8.04,14.07,11]tetradecane-5,12-dione
2-amino-7-methyl-6-[3-(morpholin-4-yl)propyl]-5-oxo-4-(2,4,5-trimethoxyphenyl)-5,6-dihydro-4H-pyrano[3,2-c]pyridine-3-carbonitrile
2-[4-[(1-Cyclopentyl-5-tetrazolyl)-(6-quinolinyl)methyl]-1-piperazinyl]-1,3-benzothiazole
N-[(2S,4aS,12aR)-2-[2-(cyclopentylamino)-2-oxoethyl]-5-methyl-6-oxo-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-8-yl]-5-methyl-3-isoxazolecarboxamide
N-[(2R,4aS,12aR)-2-[2-(cyclopentylamino)-2-oxoethyl]-5-methyl-6-oxo-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-8-yl]-5-methyl-3-isoxazolecarboxamide
N-[(2R,4aR,12aS)-2-[2-(cyclopentylamino)-2-oxoethyl]-5-methyl-6-oxo-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-8-yl]-5-methyl-1,2-oxazole-3-carboxamide
N-[(2S,4aR,12aS)-2-[2-(cyclopentylamino)-2-oxoethyl]-5-methyl-6-oxo-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-8-yl]-5-methyl-3-isoxazolecarboxamide
N-[(2R,4aR,12aR)-2-[2-(cyclopentylamino)-2-oxoethyl]-5-methyl-6-oxo-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-8-yl]-5-methyl-1,2-oxazole-3-carboxamide
1-(1,3-benzodioxol-5-yl)-3-[(2S,3R,6S)-2-(hydroxymethyl)-6-[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]-3-oxanyl]urea
1-(1,3-benzodioxol-5-yl)-3-[(2S,3R,6R)-2-(hydroxymethyl)-6-[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]-3-oxanyl]urea
1-(1,3-benzodioxol-5-yl)-3-[(2S,3S,6R)-2-(hydroxymethyl)-6-[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]-3-oxanyl]urea
N-[(2S,4aR,12aR)-2-[2-(cyclopentylamino)-2-oxoethyl]-5-methyl-6-oxo-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-8-yl]-5-methyl-3-isoxazolecarboxamide
(1S)-2-(cyclopropylmethyl)-N-(2,4-difluorophenyl)-1-(hydroxymethyl)-7-methoxy-9-methyl-1-spiro[1,3-dihydropyrido[3,4-b]indole-4,3-azetidine]carboxamide
C27H30F2N4O3 (496.22858539999993)
(1S)-2-[(4-chlorophenyl)methyl]-1-(hydroxymethyl)-7-methoxy-9-methyl-N-propan-2-yl-1-spiro[1,3-dihydropyrido[3,4-b]indole-4,3-azetidine]carboxamide
C27H33ClN4O3 (496.2241058000001)
1-(1,3-benzodioxol-5-yl)-3-[(2R,3S,6R)-2-(hydroxymethyl)-6-[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]-3-oxanyl]urea
1-(1,3-benzodioxol-5-yl)-3-[(2R,3S,6S)-2-(hydroxymethyl)-6-[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]-3-oxanyl]urea
1-(1,3-benzodioxol-5-yl)-3-[(2S,3S,6S)-2-(hydroxymethyl)-6-[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]-3-oxanyl]urea
1-(1,3-benzodioxol-5-yl)-3-[(2R,3R,6R)-2-(hydroxymethyl)-6-[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]-3-oxanyl]urea
1-(1,3-benzodioxol-5-yl)-3-[(2R,3R,6S)-2-(hydroxymethyl)-6-[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]-3-oxanyl]urea
N-[(2S,4aS,12aS)-2-[2-(cyclopentylamino)-2-oxoethyl]-5-methyl-6-oxo-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-8-yl]-5-methyl-3-isoxazolecarboxamide
1-[(1R)-2-[(2-chlorophenyl)methyl]-1-(hydroxymethyl)-7-methoxy-9-methyl-1-spiro[1,3-dihydropyrido[3,4-b]indole-4,3-azetidine]yl]-2-(dimethylamino)ethanone
C27H33ClN4O3 (496.2241058000001)
(1R)-2-(cyclopropylmethyl)-N-(2,4-difluorophenyl)-1-(hydroxymethyl)-7-methoxy-9-methyl-1-spiro[1,3-dihydropyrido[3,4-b]indole-4,3-azetidine]carboxamide
C27H30F2N4O3 (496.22858539999993)
(1R)-2-[(4-chlorophenyl)methyl]-1-(hydroxymethyl)-7-methoxy-9-methyl-N-propan-2-yl-1-spiro[1,3-dihydropyrido[3,4-b]indole-4,3-azetidine]carboxamide
C27H33ClN4O3 (496.2241058000001)
(1S,3R,4S,8S,10R)-3,10-dihydroxy-6,13-bis[(2E,4E)-1-hydroxyhexa-2,4-dienylidene]-1,4,8,11-tetramethyl-2,9-dioxapentacyclo[8.4.0.03,8.04,14.07,11]tetradecane-5,12-dione
(1R,4S,5E,7R,8S)-7-[(2E,4E)-hexa-2,4-dienoyl]-3-hydroxy-8-[(2S)-3-hydroxy-2,4-dimethyl-5-oxofuran-2-yl]-5-[(2E,4E)-1-hydroxyhexa-2,4-dienylidene]-1,3-dimethylbicyclo[2.2.2]octane-2,6-dione
(1R,3R,4S,5Z,7R,8S)-7-[(2E,4E)-hexa-2,4-dienoyl]-3-hydroxy-8-[(2S)-3-hydroxy-2,4-dimethyl-5-oxofuran-2-yl]-5-[(2E,4E)-1-hydroxyhexa-2,4-dienylidene]-1,3-dimethylbicyclo[2.2.2]octane-2,6-dione
(5E)-7-[(2E,4E)-hexa-2,4-dienoyl]-3-hydroxy-8-(3-hydroxy-2,4-dimethyl-5-oxofuran-2-yl)-5-[(2E,4E)-1-hydroxyhexa-2,4-dienylidene]-1,3-dimethylbicyclo[2.2.2]octane-2,6-dione
Simarubaceae
C254 - Anti-Infective Agent > C276 - Antiparasitic Agent > C277 - Antiprotozoal Agent D000970 - Antineoplastic Agents
WZ4003
C25H29ClN6O3 (496.19895540000005)
WZ4003 is the first potent and highly specific NUAK kinase inhibitor with IC50 of 20 nM/100 nM for NUAK1 (ARK5)/NUAK2, without significant inhibition on other 139 kinases.
[(2r,3s,4s,5r,6s)-6-{[(3s,3ar,4ar,5r,7as,9ar)-3,5-dimethyl-8-methylidene-2-oxo-octahydro-3h-azuleno[6,5-b]furan-5-yl]oxy}-5-(acetyloxy)-3,4-dihydroxyoxan-2-yl]methyl acetate
(6as,12ar)-12a-hydroxy-9-{[(2e,5e)-7-hydroxy-3,7-dimethylocta-2,5-dien-1-yl]oxy}-2,3-dimethoxy-6,6a-dihydro-5,7-dioxatetraphen-12-one
n-(5-hydroxy-5-{6-[(2-hydroxy-5-oxocyclopent-1-en-1-yl)-c-hydroxycarbonimidoyl]hexa-1,3,5-trien-1-yl}-2-oxo-7-oxabicyclo[4.1.0]hept-3-en-3-yl)-4-methyloct-2-enimidic acid
12a-hydroxy-9-[(7-hydroxy-3,7-dimethylocta-2,5-dien-1-yl)oxy]-2,3-dimethoxy-6,6a-dihydro-5,7-dioxatetraphen-12-one
4-(dimethylamino)-5-methoxy-6-methyl-29-oxa-1,7,17-triazaoctacyclo[12.12.2.1²,⁶.0⁷,²⁸.0⁸,¹³.0¹⁵,¹⁹.0²⁰,²⁷.0²¹,²⁶]nonacosa-8(13),9,11,14(28),15(19),17,20(27),21(26),22,24-decaene-3,18-diol
7-(hexa-2,4-dienoyl)-3,6,10-trihydroxy-11-(1-hydroxyhexa-2,4-dien-1-ylidene)-3,5,8,10-tetramethyltricyclo[6.2.2.0²,⁷]dodec-5-ene-4,9,12-trione
(1r,6r,7s,7ar)-4,7-bis[(acetyloxy)methyl]-7-hydroxy-6-[(3-methylbutanoyl)oxy]-1h,6h,7ah-cyclopenta[c]pyran-1-yl (3s)-3-methylpentanoate
10-acetoxy-1-homovaltratehydrin
{"Ingredient_id": "HBIN000042","Ingredient_name": "10-acetoxy-1-homovaltratehydrin","Alias": "NA","Ingredient_formula": "C25H36O10","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "200","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
1-(3-{3-[(1-carboxy-2-methylpropyl)carbamoyl]-6-hydroxy-9h-pyrido[3,4-b]indol-1-yl}propanoyl)pyrrolidine-2-carboxylic acid
[5-(acetyloxy)-6-({3,5-dimethyl-8-methylidene-2-oxo-octahydro-3h-azuleno[6,5-b]furan-5-yl}oxy)-3,4-dihydroxyoxan-2-yl]methyl acetate
(2e,4s)-n-[(1s,5s,6r)-5-hydroxy-5-[(1e,3e,5e)-6-[(2-hydroxy-5-oxocyclopent-1-en-1-yl)-c-hydroxycarbonimidoyl]hexa-1,3,5-trien-1-yl]-2-oxo-7-oxabicyclo[4.1.0]hept-3-en-3-yl]-4-methyloct-2-enimidic acid
2-{[(2r,3r,6s,8s,9r)-3,9-dimethyl-8-[1-oxo-1-(1h-pyrrol-2-yl)propan-2-yl]-1,7-dioxaspiro[5.5]undecan-2-yl]methyl}-5-hydroxy-1,3-benzoxazole-4-carboxylic acid
(3ar,4r,5r,6r,8r,10r,11r,11as)-5,8,10-trihydroxy-6,10-dimethyl-11-{[(2r)-2-methylbutanoyl]oxy}-3-methylidene-2,9-dioxo-octahydrocyclodeca[b]furan-4-yl (2z)-2-methylbut-2-enoate
3-(3,4-dimethoxyphenyl)-7a,11b-dihydroxy-5a,8,8,11a-tetramethyl-7,12-dihydro-6h-2,5-dioxatetraphene-1,11-dione
5,8,10-trihydroxy-6,10-dimethyl-11-[(2-methylbutanoyl)oxy]-3-methylidene-2,9-dioxo-octahydrocyclodeca[b]furan-4-yl 2-methylbut-2-enoate
(6as,12as)-12a-hydroxy-9-{[(2e,5e)-7-hydroxy-3,7-dimethylocta-2,5-dien-1-yl]oxy}-2,3-dimethoxy-6,6a-dihydro-5,7-dioxatetraphen-12-one
(1s,2s,3s,7r,8r,10s,11e)-7-[(2e,4e)-hexa-2,4-dienoyl]-3,6,10-trihydroxy-11-[(2e,4e)-1-hydroxyhexa-2,4-dien-1-ylidene]-3,5,8,10-tetramethyltricyclo[6.2.2.0²,⁷]dodec-5-ene-4,9,12-trione
(2e)-n-[(1s,5r,6r)-5-hydroxy-5-[(1e,3e,5e)-6-[(2-hydroxy-5-oxocyclopent-1-en-1-yl)-c-hydroxycarbonimidoyl]hexa-1,3,5-trien-1-yl]-2-oxo-7-oxabicyclo[4.1.0]hept-3-en-3-yl]-4-methyloct-2-enimidic acid
(1r,3s,4s,7r,8s)-7-[(2e,4e)-hexa-2,4-dienoyl]-3-hydroxy-8-[(2r)-3-hydroxy-2,4-dimethyl-5-oxofuran-2-yl]-5-[(2e,4e)-1-hydroxyhexa-2,4-dien-1-ylidene]-1,3-dimethylbicyclo[2.2.2]octane-2,6-dione
2-{[(2r,3r,9r)-3,9-dimethyl-8-[1-oxo-1-(1h-pyrrol-2-yl)propan-2-yl]-1,7-dioxaspiro[5.5]undecan-2-yl]methyl}-5-hydroxy-1,3-benzoxazole-4-carboxylic acid
2-{[(2r,3s,6r,8r,9r)-3,9-dimethyl-8-[(2s)-1-oxo-1-(1h-pyrrol-2-yl)propan-2-yl]-1,7-dioxaspiro[5.5]undecan-2-yl]methyl}-5-hydroxy-1,3-benzoxazole-4-carboxylic acid
(4ar,5s,6r,8ar,9as)-5-(acetyloxy)-9a-methoxy-3,5,8a-trimethyl-2-oxo-4h,4ah,6h,7h,8h,9h-naphtho[2,3-b]furan-6-yl (2s,3s)-3-(acetyloxy)-2-hydroxy-2-methylbutanoate
2-acetyl-4-[(8-acetyl-5,7-dihydroxy-2,2-dimethylchromen-6-yl)methyl]-3,5-dihydroxy-6-methyl-6-(3-methylbut-2-en-1-yl)cyclohexa-2,4-dien-1-one
(2r,3r,4s,5r)-2,3,4,5-tetrahydroxy-6-oxohexyl (1s,2's,4r,5r)-5-ethenyl-4-hydroxy-3',3',5-trimethyl-3-oxo-6,7-dihydro-4h-spiro[2-benzofuran-1,1'-cyclohexane]-2'-carboxylate
(1s,3r,4r,6e,8s,10r,11r,13e)-3,10-dihydroxy-6,13-bis[(2e,4e)-1-hydroxyhexa-2,4-dien-1-ylidene]-1,4,8,11-tetramethyl-2,9-dioxapentacyclo[8.4.0.0³,⁸.0⁴,¹⁴.0⁷,¹¹]tetradecane-5,12-dione
(1r,2s,6s,7s,8s,9s,12e)-2-[(2e,4e)-hexa-2,4-dienoyl]-5,6,9-trihydroxy-12-[(2e,4e)-1-hydroxyhexa-2,4-dien-1-ylidene]-1,4,6,9-tetramethyltricyclo[6.2.2.0²,⁷]dodec-4-ene-3,10,11-trione
(2s,3r,4r,6r)-4-(dimethylamino)-3-methoxy-2-methyl-29-oxa-1,7,17-triazaoctacyclo[12.12.2.1²,⁶.0⁷,²⁸.0⁸,¹³.0¹⁵,¹⁹.0²⁰,²⁷.0²¹,²⁶]nonacosa-8(13),9,11,14(28),15(19),16,20(27),21(26),22,24-decaene-11,16-diol
6-(acetyloxy)-4-({[2-(acetyloxy)-3-methylbutanoyl]oxy}methyl)-4a,5,6,7a-tetrahydro-1h-spiro[cyclopenta[c]pyran-7,2'-oxiran]-1-yl 3-methylpentanoate
(1r,3s,4s,5z,7r,8s)-7-[(2e,4e)-hexa-2,4-dienoyl]-3-hydroxy-8-[(2s)-3-hydroxy-2,4-dimethyl-5-oxofuran-2-yl]-5-[(2e,4e)-1-hydroxyhexa-2,4-dien-1-ylidene]-1,3-dimethylbicyclo[2.2.2]octane-2,6-dione
(2s)-1-[3-(3-{[(1s)-1-carboxy-2-methylpropyl]carbamoyl}-6-hydroxy-9h-pyrido[3,4-b]indol-1-yl)propanoyl]pyrrolidine-2-carboxylic acid
(1r,3s,4s,5z,7r,8r)-7-[(2e,4e)-hexa-2,4-dienoyl]-3-hydroxy-8-[(2s)-3-hydroxy-2,4-dimethyl-5-oxofuran-2-yl]-5-[(2e,4e)-1-hydroxyhexa-2,4-dien-1-ylidene]-1,3-dimethylbicyclo[2.2.2]octane-2,6-dione
(1s,6s,7r,7as)-4,7-bis[(acetyloxy)methyl]-7-hydroxy-6-[(3-methylbutanoyl)oxy]-1h,6h,7ah-cyclopenta[c]pyran-1-yl (3s)-3-methylpentanoate
7-(hexa-2,4-dienoyl)-3-hydroxy-8-(3-hydroxy-2,4-dimethyl-5-oxofuran-2-yl)-5-(1-hydroxyhexa-2,4-dien-1-ylidene)-1,3-dimethylbicyclo[2.2.2]octane-2,6-dione
4-(dimethylamino)-3-methoxy-2-methyl-29-oxa-1,7,17-triazaoctacyclo[12.12.2.1²,⁶.0⁷,²⁸.0⁸,¹³.0¹⁵,¹⁹.0²⁰,²⁷.0²¹,²⁶]nonacosa-8(13),9,11,14(28),15(19),16,20(27),21(26),22,24-decaene-11,16-diol
(6ar,12as)-12a-hydroxy-9-{[(2e,5e)-7-hydroxy-3,7-dimethylocta-2,5-dien-1-yl]oxy}-2,3-dimethoxy-6,6a-dihydro-5,7-dioxatetraphen-12-one
(2r,3s,4r,5r,6r)-2-(hydroxymethyl)-6-{2-[(3s)-2-(hydroxymethyl)-3-({[(2r,3r,4r,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)cyclopent-1-en-1-yl]ethoxy}oxane-3,4,5-triol
{1-carboxy-2-[(5z)-5-[9-carboxy-9-(3-methylbutyl)non-6-en-2,4-diyn-1-ylidene]imidazo[2,1-b][1,3]thiazin-2-yl]ethyl}trimethylazanium
[C27H34N3O4S]+ (496.2269904000001)
2,3,4,5-tetrahydroxy-6-oxohexyl 5-ethenyl-4-hydroxy-3',3',5-trimethyl-3-oxo-6,7-dihydro-4h-spiro[2-benzofuran-1,1'-cyclohexane]-2'-carboxylate
(1s,4s,5r,6r,7s,8r,11r,13s,16s,17s,18s,19r)-4,5,16,17-tetrahydroxy-6,14,18-trimethyl-9-oxo-3,10-dioxapentacyclo[9.8.0.0¹,⁷.0⁴,¹⁹.0¹³,¹⁸]nonadec-14-en-8-yl (2s)-2-hydroxy-2-methylbutanoate
12a-hydroxy-9-{[(2e,5e)-7-hydroxy-3,7-dimethylocta-2,5-dien-1-yl]oxy}-2,3-dimethoxy-6,6a-dihydro-5,7-dioxatetraphen-12-one
(2s,6s,7r,9s,13z)-4-[(2e,4e)-hexa-2,4-dienoyl]-6,7,12-trihydroxy-13-[(2e,4e)-1-hydroxyhexa-2,4-dien-1-ylidene]-2,6,9,11-tetramethyl-8-oxatricyclo[7.4.0.0²,⁷]trideca-3,11-diene-5,10-dione
(1s,4as,6s,7r,7as)-6-(acetyloxy)-4-({[(2r)-2-(acetyloxy)-3-methylbutanoyl]oxy}methyl)-4a,5,6,7a-tetrahydro-1h-spiro[cyclopenta[c]pyran-7,2'-oxiran]-1-yl (3s)-3-methylpentanoate
(1s,2r,4s,7s,8s,11r,12s,17r,19r)-7-(furan-3-yl)-1,8,12,16,16-pentamethyl-5,10,15-trioxo-3,6-dioxapentacyclo[9.8.0.0²,⁴.0²,⁸.0¹²,¹⁷]nonadec-13-en-19-yl acetate
2-(hydroxymethyl)-6-{2-[2-(hydroxymethyl)-3-({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)cyclopent-1-en-1-yl]ethoxy}oxane-3,4,5-triol
4,7-bis[(acetyloxy)methyl]-7-hydroxy-6-[(3-methylbutanoyl)oxy]-1h,6h,7ah-cyclopenta[c]pyran-1-yl 3-methylpentanoate
2-acetyl-4-[(6-acetyl-5,7-dihydroxy-2,2-dimethylchromen-8-yl)methyl]-3,5-dihydroxy-6-methyl-6-(3-methylbut-2-en-1-yl)cyclohexa-2,4-dien-1-one
(2s,4z,9s,11r,12s,13r,15s,18s,19s)-18-(furan-3-yl)-8,8,12,19-tetramethyl-6,16-dioxo-7,14,17-trioxapentacyclo[10.9.0.0²,⁹.0¹³,¹⁵.0¹³,¹⁹]henicosa-1(21),4-dien-11-yl acetate
(2e,4e)-1-[(1r,3s,4r,7r,8r,10s,11r,14r)-12-[(2e,4e)-hexa-2,4-dienoyl]-1,6,8,13-tetrahydroxy-3,7,10,14-tetramethyl-2,9-dioxapentacyclo[8.4.0.0³,⁸.0⁴,¹⁴.0⁷,¹¹]tetradeca-5,12-dien-5-yl]hexa-2,4-dien-1-one
(1s,3r,4r,6z,7s,8s,10r,11r,13z,14s)-3,10-dihydroxy-6,13-bis[(2e,4e)-1-hydroxyhexa-2,4-dien-1-ylidene]-1,4,8,11-tetramethyl-2,9-dioxapentacyclo[8.4.0.0³,⁸.0⁴,¹⁴.0⁷,¹¹]tetradecane-5,12-dione
(1s,6s,7r,7as)-4,7-bis[(acetyloxy)methyl]-7-hydroxy-6-[(3-methylbutanoyl)oxy]-1h,6h,7ah-cyclopenta[c]pyran-1-yl (3r)-3-methylpentanoate
(1r,3s,4s,5e,7r,8s)-7-[(2e,4e)-hexa-2,4-dienoyl]-3-hydroxy-8-[(2s)-3-hydroxy-2,4-dimethyl-5-oxofuran-2-yl]-5-[(2e,4e)-1-hydroxyhexa-2,4-dien-1-ylidene]-1,3-dimethylbicyclo[2.2.2]octane-2,6-dione
(5z)-7-[(2e,4e)-hexa-2,4-dienoyl]-3-hydroxy-8-[(2s)-3-hydroxy-2,4-dimethyl-5-oxofuran-2-yl]-5-[(2e,4e)-1-hydroxyhexa-2,4-dien-1-ylidene]-1,3-dimethylbicyclo[2.2.2]octane-2,6-dione
{1-carboxy-2-[(5e)-5-[9-carboxy-9-(3-methylbutyl)non-6-en-2,4-diyn-1-ylidene]imidazo[2,1-b][1,3]thiazin-2-yl]ethyl}trimethylazanium
[C27H34N3O4S]+ (496.2269904000001)