Exact Mass: 328.1846
Exact Mass Matches: 328.1846
Found 500 metabolites which its exact mass value is equals to given mass value 328.1846,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
(all-E)-Crocetin
Crocetin is a 20-carbon dicarboxylic acid which is a diterpenoid and natural carotenoid. Found in the crocus flower, it has been administered as an anti-fatigue dietary supplement. It has a role as a nutraceutical, a metabolite and an antioxidant. It is a carotenoic acid, a diterpenoid and a polyunsaturated dicarboxylic acid. It is a conjugate acid of a crocetin(2-). Vitamin A-analog that increases diffusivity of oxygen in aqueous solutions, including plasma. Crocetin is a natural product found in Verbascum lychnitis, Gardenia jasminoides, and other organisms with data available. cis-Crocetin is found in herbs and spices. cis-Crocetin is occurs as glycoside in saffro COVID info from clinicaltrial, clinicaltrials, clinical trial, clinical trials D020011 - Protective Agents > D000975 - Antioxidants > D002338 - Carotenoids Occurs as glycoside in saffron. cis-Crocetin is found in herbs and spices. D020011 - Protective Agents > D016588 - Anticarcinogenic Agents D000970 - Antineoplastic Agents Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS
Labetalol
Labetalol is only found in individuals that have used or taken this drug. It is a blocker of both alpha- and beta-adrenergic receptors that is used as an antihypertensive (PubChem). Labetalol HCl combines both selective, competitive, alpha-1-adrenergic blocking and nonselective, competitive, beta-adrenergic blocking activity in a single substance. In man, the ratios of alpha- to beta- blockade have been estimated to be approximately 1:3 and 1:7 following oral and intravenous (IV) administration, respectively. The principal physiologic action of labetalol is to competitively block adrenergic stimulation of β-receptors within the myocardium (β1-receptors) and within bronchial and vascular smooth muscle (β2-receptors), and α1-receptors within vascular smooth muscle. This causes a decrease in systemic arterial blood pressure and systemic vascular resistance without a substantial reduction in resting heart rate, cardiac output, or stroke volume, apparently because of its combined α- and β-adrenergic blocking activity. CONFIDENCE standard compound; INTERNAL_ID 220; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7134; ORIGINAL_PRECURSOR_SCAN_NO 7131 CONFIDENCE standard compound; INTERNAL_ID 220; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7100; ORIGINAL_PRECURSOR_SCAN_NO 7098 CONFIDENCE standard compound; INTERNAL_ID 220; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7094; ORIGINAL_PRECURSOR_SCAN_NO 7091 CONFIDENCE standard compound; INTERNAL_ID 220; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7132; ORIGINAL_PRECURSOR_SCAN_NO 7130 CONFIDENCE standard compound; INTERNAL_ID 220; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3398; ORIGINAL_PRECURSOR_SCAN_NO 3397 CONFIDENCE standard compound; INTERNAL_ID 220; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3392; ORIGINAL_PRECURSOR_SCAN_NO 3391 CONFIDENCE standard compound; INTERNAL_ID 220; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3400; ORIGINAL_PRECURSOR_SCAN_NO 3399 CONFIDENCE standard compound; INTERNAL_ID 220; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7150; ORIGINAL_PRECURSOR_SCAN_NO 7149 CONFIDENCE standard compound; INTERNAL_ID 220; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3395; ORIGINAL_PRECURSOR_SCAN_NO 3393 CONFIDENCE standard compound; INTERNAL_ID 220; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3466; ORIGINAL_PRECURSOR_SCAN_NO 3465 CONFIDENCE standard compound; INTERNAL_ID 220; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3405; ORIGINAL_PRECURSOR_SCAN_NO 3404 CONFIDENCE standard compound; INTERNAL_ID 220; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7142; ORIGINAL_PRECURSOR_SCAN_NO 7140 C - Cardiovascular system > C07 - Beta blocking agents > C07A - Beta blocking agents > C07AG - Alpha and beta blocking agents C78272 - Agent Affecting Nervous System > C29747 - Adrenergic Agent > C72900 - Adrenergic Antagonist D018373 - Peripheral Nervous System Agents > D001337 - Autonomic Agents > D013566 - Sympathomimetics D018377 - Neurotransmitter Agents > D018663 - Adrenergic Agents > D018674 - Adrenergic Antagonists D002317 - Cardiovascular Agents > D000959 - Antihypertensive Agents CONFIDENCE standard compound; INTERNAL_ID 2757 CONFIDENCE standard compound; INTERNAL_ID 8188 Labetalol (AH5158) is an orally active selective α1- and non-selective β-adrenergic receptors competitive antagonist. Labetalol, an anti-hypertensive agent, can be used for the research of cardiovascular disease, such as hypertension in pregnancy[1][2][3].
GELSEDINE
Sobetirome
C78276 - Agent Affecting Digestive System or Metabolism > C29703 - Antilipidemic Agent Same as: D09381
5-Geranyloxy-7-methoxycoumarin
5-Geranyloxy-7-methoxycoumarin is found in citrus. 5-Geranyloxy-7-methoxycoumarin is isolated from lime oil (Citrus aurantifolia). Isolated from lime oil (Citrus aurantifolia). 5-Geranyloxy-7-methoxycoumarin is found in lime, lemon, and citrus. 5-Geranyloxy-7-methoxycoumarin is a terpene lactone.
Macelignan
Macelignan is found in herbs and spices. Macelignan is a constituent of Myristica fragrans (nutmeg) Constituent of Myristica fragrans (nutmeg). Macelignan is found in herbs and spices. Macelignan ((+)-Anwulignan; Anwuligan)?is an orally active lignan isolated from Myristica fragrans. Macelignan possesses many pharmacological activities, including anti-inflammatory, anti-cancer, anti-diabetes, and neuroprotective activities[1][2][3]. Macelignan ((+)-Anwulignan; Anwuligan)?is an orally active lignan isolated from Myristica fragrans. Macelignan possesses many pharmacological activities, including anti-inflammatory, anti-cancer, anti-diabetes, and neuroprotective activities[1][2][3].
5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-phenyl-3-heptanone
5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-phenyl-3-heptanone is found in herbs and spices. 5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-phenyl-3-heptanone is isolated from Alpinia officinarum (lesser galangal
8-Methoxygravelliferone
8-Methoxygravelliferone is found in herbs and spices. 8-Methoxygravelliferone is a constituent of Ruta graveolens (rue)
Guaiacin
Guaiacin is found in herbs and spices. Guaiacin is a constituent of Myristica fragrans (nutmeg). Constituent of Myristica fragrans (nutmeg). Guaiacin is found in ucuhuba and herbs and spices. Guaiacin is a arylnaphthalene type lignin isolated from the barks of Machilus thunbergii SIEB. et ZUCC (Lauraceae). Guaiacin significantly increases alkaline phosphatase activity and osteoblast differentiation[1].
Sclareapinone
Sclareapinone is found in alcoholic beverages. Sclareapinone is a constituent of Salvia sclarea (clary sage)
4,4'-Dihydroxy-5,5'-diisopropyl-2,2'-dimethyl-3,6-biphenyldione
4,4-Dihydroxy-5,5-diisopropyl-2,2-dimethyl-3,6-biphenyldione is found in herbs and spices. 4,4-Dihydroxy-5,5-diisopropyl-2,2-dimethyl-3,6-biphenyldione is a constituent of the leaves of thyme Thymus vulgaris. Shows antioxidant activity. Constituent of the leaves of thyme Thymus vulgaris. Shows antioxidant activity. 4,4-Dihydroxy-5,5-diisopropyl-2,2-dimethyl-3,6-biphenyldione is found in herbs and spices.
Sagequinone methide A
Constituent of Salvia officinalis (sage). Sagequinone methide A is found in tea, herbs and spices, and common sage. Sagequinone methide A is found in common sage. Sagequinone methide A is a constituent of Salvia officinalis (sage)
8-O-Methyloblongine
8-O-Methyloblongine is found in fruits. 8-O-Methyloblongine is an alkaloid from stems of Litsea cubeba (mountain pepper Alkaloid from stems of Litsea cubeba (mountain pepper). 8-O-Methyloblongine is found in fruits.
7-hydroxygranisetron
7-hydroxygranisetron is a metabolite of granisetron. Granisetron is a serotonin 5-HT3 receptor antagonist used as an antiemetic to treat nausea and vomiting following chemotherapy. Its main effect is to reduce the activity of the vagus nerve, which is a nerve that activates the vomiting center in the medulla oblongata. It does not have much effect on vomiting due to motion sickness. This drug does not have any effect on dopamine receptors or muscarinic receptors. (Wikipedia)
5-(Biotinamido)pentylamine
7-Hydroxy granisetron
Glycylprolylarginine
Benzamide, 3-(3-((2-(3,4-dihydroxyphenyl)ethyl)amino)butyl)-
Macelignan
4-[(2S,3R)-4-(1,3-benzodioxol-5-yl)-2,3-dimethylbutyl]-2-methoxyphenol is a lignan. Macelignan is an NSAID with antioxidant, free radical scavenging, and neuroprotective activities. Macelignan is a natural product found in Saururus cernuus, Schisandra sphenanthera, and other organisms with data available. Macelignan is a lignan isolated from nutmeg with antimicrobial and anticariogenic activity against Streptococcus mutans and other streptococcus species. C254 - Anti-Infective Agent > C52588 - Antibacterial Agent Macelignan ((+)-Anwulignan; Anwuligan)?is an orally active lignan isolated from Myristica fragrans. Macelignan possesses many pharmacological activities, including anti-inflammatory, anti-cancer, anti-diabetes, and neuroprotective activities[1][2][3]. Macelignan ((+)-Anwulignan; Anwuligan)?is an orally active lignan isolated from Myristica fragrans. Macelignan possesses many pharmacological activities, including anti-inflammatory, anti-cancer, anti-diabetes, and neuroprotective activities[1][2][3].
Guaiacin
(+)-guaiacin is a lignan. It has a role as a metabolite. Guaiacin is a natural product found in Magnolia kachirachirai, Saururus cernuus, and other organisms with data available. A natural product found in Machilus robusta. Guaiacin is a arylnaphthalene type lignin isolated from the barks of Machilus thunbergii SIEB. et ZUCC (Lauraceae). Guaiacin significantly increases alkaline phosphatase activity and osteoblast differentiation[1].
[3aS-(3aalpha,5alpha,6aalpha,9aalpha,9bbeta)]-Dodecahydro-3,6,9-tris(methylene)-2-oxoazuleno[4,5-b]furan-5-yl ester 3-methyl-2-butenoic acid
7-Geranyloxy-6-methoxycoumarin
7-Geranyloxy-6-methoxycoumarin is a natural product found in Atalantia monophylla, Murraya siamensis, and other organisms with data available.
[3aS-[3aalpha,5alpha(Z),6aalpha,9aalpha,9bbeta]]-Dodecahydro-3,6,9-tris(methylene)-2-oxoazuleno[4,5-b]furan-5-yl ester 2-methyl-2-butenoic acid
6beta-Angeloyloxy-9,10-didehydrofuranoeremophilan-1-one
11,14-dihydroxy-12,16-epoxyabieta-5,8,11,13-tetraen-7-one
1-deoxycarinatone|2-[(1S)-2-(4-hydroxy-3-methoxyphenyl)-1-methylethyl]-6-methoxy-4-(prop-2-enyl)phenol
15,16-epoxy-12-oxo-8(17),13(16),14-ent-labdatrien-20,19-olide
(3R)-3,4-epoxy-1-(4-hydroxyphenyl)-7-(3-methoxyphenyl) heptan-3-ol|Diarylheptanoid CPB-51-262-2
2beta-angeloyloxy-1,2,5,6-tetrahydrochromolaenin-8-one
3,4,18beta-cyclopropa-7beta-hydroxy-14-oxo-ent-abieta-8,9,13,15-dien-16,12-olide|retusolide D
9alpha-9-Hydroxy-1,8(14)15-isopimaratriene-3,7,11-trione
(ent-6alpha,7alpha,8alpha,12alphaH)7,12:15,16-Diepoxy-3,13(16),14-clerodatrien-18,6-olide
7-hydroxy-15,16-epoxy-17-al-7,11,13(16)-labdatetraene-6-one|7-hydroxyhydichinal
(2S)-4,7-dihydroxy-8-(3-hydroxy-3-methylbutyl)flavan|brosimacutin L
6beta-angeloyloxyfuranoeremophil-1(10)-en-2-one|virgaurenone A
(+)-(5S,6S,7S,8R,10R)-6-hydroxy-7,8-epoxy-12-oxo-abieta-9(11),13-dien-20-oic acid 6,20-lactone
An abietane diterpenoid isolated from the stem bark of Fraxinus sieboldiana.
(+)-(5S,6S,10R)-12-hydroxy-7-oxo-abieta-8,11,13-trien-20-oic acid 6,20-lactone
juglanin B
A cyclic ketone isolated from the extract of the seed husks of walnuts Juglans regia and has been shown to exhibit cytotoxic activity against human hepatoma cells.
1beta,10beta(8,12)-diepoxy-7beta,11beta-dihydroxy-8beta,12alpha-dimethoxyeremophilane
(3S,6R,9S,10R)-9-hydroxy-3-methyl-2,4-dioxo-10-pentyloxecan-6-yl acetate|cytospolide P
4-{(2S,6R)-6-[2-(4-hydroxyphenyl)ethyl]-tetrahydropyran-2-yl}-2-methoxyphenol|engelheptanoxide A
(3S)-1-(3-methoxy-4-hydroxyphenyl)-7-(4-hydroxyphenyl)-(6E)-6-hepten-3-ol
1-(3,5-dihydroxy-4-methoxyphenyl)-7-phenyl-3-heptanone
6-hydroxy-7-[(E,E)-3,7?-dimethyl-7?-hydroxy-2?,5?-octadienyloxy]coumarin
13-Allyl-3,12-dihydroxypodocarpa-6,8,12-triene-11,14-dione #
3beta-acetoxy-5alpha,11,12,13-tetrahydroxy-eudesm-4(15)-ene|3??-Acetoxy,5??,11,12,13-tetrahydroxy-eudesm-4(15)-ene
7beta,14,19-trihydroxy-18(4->3)abeo-abieta-3,8,11,13-tetraen-18-oic acid lactone
(1E,6E,12E)-xenica-1(9),6,12,14-tetraene-17,18:19,18-diolide
1,5-dioxo-2,3-dihydroxyrhamnofola-4(10),6,11(18),15-tetraene
(4E)-1,5-bis(4-hydroxyphenyl)-1-methoxy-2-(methoxymethyl)-4-pentene
15,16-epoxy-12-oxo-ent-halima-5(10),13(16),14-trien-18,2beta-olide|ent-halimanolide
6-methoxy-8-(3-methyl-but-2-enyl)-7-(3-methyl-but-2-enyloxy)-coumarin|6-Methoxy-8-(3-methyl-but-2-enyl)-7-(3-methyl-but-2-enyloxy)-cumarin
2-ene-1-one-8beta,14beta-epoxy-3,15-abiatene-16,12-olide|2-ene-8beta,14beta-epoxy-1-oxo-13,15-abiatene-16,12-olide
9,11-Didehydro-GA9 methyl ester|Delta9(11)-didehydro GA9 methyl ester|ent-10beta-hydroxy-20-norgibberella-9(11),16-diene-7,19-dioic acid 7-(methyl ester) 19,10-lactone|gibberellin A73 methyl ester
10-Hydroxydihydroperaksine
Anwulignan
4-[(2R,3S)-2,3-Dimethyl-4-(1,3-benzodioxole-5-yl)butyl]-2-methoxyphenol is a natural product found in Machilus thunbergii with data available.
Triptoquinonea
Triptoquinone A is a tricyclic diterpenoid with formula C20H24O4, originally isolated from Tripterygium wilfordii. It has a role as a plant metabolite and an EC 1.14.13.39 (nitric oxide synthase) inhibitor. It is an alpha,beta-unsaturated monocarboxylic acid, an abietane diterpenoid, a carbotricyclic compound, a tricyclic diterpenoid, a member of p-quinones and a cyclic terpene ketone. Triptoquinone A is a natural product found in Tripterygium wilfordii and Tripterygium doianum with data available. A tricyclic diterpenoid with formula C20H24O4, originally isolated from Tripterygium wilfordii.
labetalol
C - Cardiovascular system > C07 - Beta blocking agents > C07A - Beta blocking agents > C07AG - Alpha and beta blocking agents C78272 - Agent Affecting Nervous System > C29747 - Adrenergic Agent > C72900 - Adrenergic Antagonist D018373 - Peripheral Nervous System Agents > D001337 - Autonomic Agents > D013566 - Sympathomimetics D018377 - Neurotransmitter Agents > D018663 - Adrenergic Agents > D018674 - Adrenergic Antagonists D002317 - Cardiovascular Agents > D000959 - Antihypertensive Agents Labetalol (AH5158) is an orally active selective α1- and non-selective β-adrenergic receptors competitive antagonist. Labetalol, an anti-hypertensive agent, can be used for the research of cardiovascular disease, such as hypertension in pregnancy[1][2][3].
4-[4-(1,3-benzodioxol-5-yl)-2,3-dimethylbutyl]-2-methoxyphenol
6-[(3,3-dimethyloxiran-2-yl)methyl]-7-methoxy-3-(2-methylbut-3-en-2-yl)chromen-2-one
(2S)-2-[(1S)-1-carboxyundecyl]-5-oxooxolane-2-carboxylic acid
2-methoxy-4-[2-(2-methoxy-4-prop-2-enylphenoxy)propyl]phenol
4-[5-(3,4-dimethoxyphenyl)-3,4-dimethyloxolan-2-yl]phenol
C20H24O4_(3E,12E)-3,12-Dimethyl-8-methylene-6,18-dioxatricyclo[14.2.1.0~5,9~]nonadeca-3,12,16(19)-triene-7,17-dione
C20H24O4_1,7-Bis(4-hydroxyphenyl)-5-methoxy-3-heptanone
(2S)-2-[(1S)-1-carboxyundecyl]-5-oxotetrahydrofuran-2-carboxylic acid
(3E,12E)-3,12-dimethyl-8-methylidene-6,18-dioxatricyclo[14.2.1.0⁵,⁹]nonadeca-3,12,16(19)-triene-7,17-dione
4-[5-(3,4-dimethoxyphenyl)-3,4-dimethyloxolan-2-yl]phenol
4-[(Z)-4-(4-hydroxy-3-methoxyphenyl)-2,3-dimethylbut-3-enyl]-2-methoxyphenol
4-[4-(1,3-benzodioxol-5-yl)-2,3-dimethylbutyl]-2-methoxyphenol
Crocetin
Crocetin is a 20-carbon dicarboxylic acid which is a diterpenoid and natural carotenoid. Found in the crocus flower, it has been administered as an anti-fatigue dietary supplement. It has a role as a nutraceutical, a metabolite and an antioxidant. It is a carotenoic acid, a diterpenoid and a polyunsaturated dicarboxylic acid. It is a conjugate acid of a crocetin(2-). Vitamin A-analog that increases diffusivity of oxygen in aqueous solutions, including plasma. Crocetin is a natural product found in Verbascum lychnitis, Gardenia jasminoides, and other organisms with data available. A 20-carbon dicarboxylic acid which is a diterpenoid and natural carotenoid. Found in the crocus flower, it has been administered as an anti-fatigue dietary supplement. COVID info from clinicaltrial, clinicaltrials, clinical trial, clinical trials D020011 - Protective Agents > D000975 - Antioxidants > D002338 - Carotenoids D020011 - Protective Agents > D016588 - Anticarcinogenic Agents D000970 - Antineoplastic Agents Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS Crocetin is a natural carotenoid dicarboxylic acid that is found in the crocus flower and Gardenia jasminoides (fruits).
4-[5-(3,4-dimethoxyphenyl)-3,4-dimethyloxolan-2-yl]phenol [IIN-based: Match]
4-[5-(3,4-dimethoxyphenyl)-3,4-dimethyloxolan-2-yl]phenol [IIN-based on: CCMSLIB00000848920]
6-[(3,3-dimethyloxiran-2-yl)methyl]-7-methoxy-3-(2-methylbut-3-en-2-yl)chromen-2-one [IIN-based: Match]
4-[5-(3,4-dimethoxyphenyl)-3,4-dimethyloxolan-2-yl]phenol [IIN-based on: CCMSLIB00000848919]
4-[(Z)-4-(4-hydroxy-3-methoxyphenyl)-2,3-dimethylbut-3-enyl]-2-methoxyphenol_major
(2S)-2-[(1S)-1-carboxyundecyl]-5-oxotetrahydrofuran-2-carboxylic acid_major
4-[4-(1,3-benzodioxol-5-yl)-2,3-dimethylbutyl]-2-methoxyphenol_major
4-[5-(3,4-dimethoxyphenyl)-3,4-dimethyloxolan-2-yl]phenol_major
(3E,12E)-3,12-dimethyl-8-methylidene-6,18-dioxatricyclo[14.2.1.0?,?]nonadeca-3,12,16(19)-triene-7,17-dione
Ala Ala Ala Pro
Ala Ala Pro Ala
Ala Pro Ala Ala
Gly Gly Pro Val
Gly Gly Val Pro
Gly Pro Gly Val
Gly Pro Val Gly
Gly Val Gly Pro
Gly Val Pro Gly
Pro Ala Ala Ala
Pro Gly Gly Val
Pro Gly Val Gly
Pro Val Gly Gly
Val Gly Gly Pro
Val Gly Pro Gly
Val Pro Gly Gly
endo-1-methyl-N-(9-methyl-9-azabicyclo[3.3.1]non-3-yl)-N-oxide
5-hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-phenyl-3-heptanone
Sclareapinone
8-Methoxygravelliferone
Sagequinone methide A
8-O-Methyloblongine
Calophyn
Macelignan ((+)-Anwulignan; Anwuligan)?is an orally active lignan isolated from Myristica fragrans. Macelignan possesses many pharmacological activities, including anti-inflammatory, anti-cancer, anti-diabetes, and neuroprotective activities[1][2][3]. Macelignan ((+)-Anwulignan; Anwuligan)?is an orally active lignan isolated from Myristica fragrans. Macelignan possesses many pharmacological activities, including anti-inflammatory, anti-cancer, anti-diabetes, and neuroprotective activities[1][2][3].
4,4'-Dihydroxy-5,5'-diisopropyl-2,2'-dimethyl-3,6-biphenyldione
4-((2-(4-AMINOPHENOXY)ETHYL)(BENZYL)AMINO)BUTANOIC ACID
Acrylic acid, butyl acrylate, isobutyl acrylate polymer
N-(3-Boc-Aminomethylphenyl)-n-(4-methoxyphenyl)amine
2-(TETRAHYDRO-2H-PYRAN-2-YL)-4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-2H-INDAZOLE
1-(oxan-2-yl)-4-(tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indazole
2-Methyl-6-phenyl-N-(2-phenylethyl)-5H-pyrrolo(3,2-d)pyrimidin-4-amine
2-METHYL-1-(3-MORPHOLINOPROPYL)-5-PHENYL-1H-PYRROLE-3-CARBOXYLIC ACID
3,5-DI-TERT-BUTYL-4-HYDROXYBENZYLPHOSPHONIC ACID MONOETHYL ESTER
Serdemetan
C274 - Antineoplastic Agent > C129839 - Apoptotic Pathway-targeting Antineoplastic Agent D011838 - Radiation-Sensitizing Agents Serdemetan (JNJ-26854165) is a potent anticancer agent with radiosensitizing activity. Serdemetan exhibits antiproliferative activity in various p53 wild-type tumor cells. Serdemetan also antagonizes the Mdm2-HIF1α axis leading to decreased levels of glycolytic enzymes[1][2][3].
N-((1H-benzo[d][1,2,3]triazol-1-yl)Methyl)-N-benzyl-1-phenylmethanamine
DILEVALOL
C78272 - Agent Affecting Nervous System > C29747 - Adrenergic Agent > C72900 - Adrenergic Antagonist D018373 - Peripheral Nervous System Agents > D001337 - Autonomic Agents > D013566 - Sympathomimetics D018377 - Neurotransmitter Agents > D018663 - Adrenergic Agents > D018674 - Adrenergic Antagonists C78274 - Agent Affecting Cardiovascular System > C29707 - Vasodilating Agent D002317 - Cardiovascular Agents > D000959 - Antihypertensive Agents
Ropivacaine hydrochloride
D002491 - Central Nervous System Agents > D002492 - Central Nervous System Depressants > D000777 - Anesthetics D018373 - Peripheral Nervous System Agents > D018689 - Sensory System Agents C78272 - Agent Affecting Nervous System > C245 - Anesthetic Agent
2-methoxy-N-[[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-3-yl]methyl]ethanamine
5-[3-(Dimethylamino)-2-methylpropyl]-5H-dibenz[b,f]azepine hydrochloride
6-[[(2E)-3,7-Dimethyl-2,6-octadien-1-yl]oxy]-7-methoxy-2H-1-benzopyran-2-one
(5R)-5-hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-phenylheptan-3-one
1-[1-(4-Fluorophenyl)-2,5-dimethyl-3-pyrrolyl]-2-(4-methyl-1-piperidinyl)ethanone
(R*,S*)-(1)-5-(1-Hydroxy-2-((1-methyl-3-phenylpropyl)amino)ethyl)salicylamide
2H-1-Benzopyran-2-one, 6-[(3,3-dimethyl-2-oxiranyl)methyl]-3-(1,1-dimethyl-2-propen-1-yl)-7-methoxy-
5-(5-(4-(5-Hydro-4-methyl-2-oxazolyl)phenoxy)pentyl)-3-methyl isoxazole
Sobetirome
C78276 - Agent Affecting Digestive System or Metabolism > C29703 - Antilipidemic Agent Same as: D09381
3,12-Dimethyl-8-methylidene-6,18-dioxatricyclo[14.2.1.05,9]nonadeca-3,12,16(19)-triene-7,17-dione
1-(4-Hydroxy-3-methoxyphenyl)-7-(4-hydroxyphenyl)-3-heptanone
A diarylheptanoid that is 3-heptanone substituted by a 4-hydroxy-3-methoxyphenyl group at position 1 and a 4-hydroxyphenyl group at position 7. It has been isolated from the rhizomes of Curcuma kwangsiensis.
2-Methoxy-4-[2-(2-methoxy-4-prop-2-enylphenoxy)propyl]phenol
7-hydroxy-1-methyl-N-[(1S,5S)-9-methyl-9-azabicyclo[3.3.1]nonan-3-yl]indazole-3-carboxamide
(E)-4-[(2S,3R,4R,5S)-3,4-dihydroxy-5-[(E,4R,5S)-5-hydroxy-4-methylhex-2-enyl]oxan-2-yl]-3-methylbut-2-enoic acid
[3-Carboxy-2-(6-carboxy-3,4-dimethylidenehexanoyl)oxypropyl]-trimethylazanium
[3-carboxy-2-[(4E,7E)-8-carboxyocta-4,7-dienoyl]oxypropyl]-trimethylazanium
[3-carboxy-2-[(3E,7E)-8-carboxyocta-3,7-dienoyl]oxypropyl]-trimethylazanium
[3-carboxy-2-[(4E,6E)-8-carboxyocta-4,6-dienoyl]oxypropyl]-trimethylazanium
[3-carboxy-2-[(2E,7E)-8-carboxyocta-2,7-dienoyl]oxypropyl]-trimethylazanium
[3-carboxy-2-[(3E,6E)-8-carboxyocta-3,6-dienoyl]oxypropyl]-trimethylazanium
[3-carboxy-2-[(5E,7E)-8-carboxyocta-5,7-dienoyl]oxypropyl]-trimethylazanium
Naropin
D002491 - Central Nervous System Agents > D002492 - Central Nervous System Depressants > D000777 - Anesthetics D018373 - Peripheral Nervous System Agents > D018689 - Sensory System Agents
(+)-(5S,6S,10R)-12-hydroxy-7-oxo-abieta-8,11,13-trien-20-oic acid6,20-lactone
An abietane diterpenoid isolated from the stem bark of Fraxinus sieboldiana.
4-Cyclohexanecarbonyl-1-(2-phenylethyl)piperazine-2,6-dione
N-[(E)-Benzylideneamino]-6-methyl-2-phenyl-5-prop-2-enylpyrimidin-4-amine
2-Hydroxy-5-((1S)-1-hydroxy-2-(((1S)-1-methyl-3-phenylpropyl)amino)ethyl)benzamide
Val-Asn-Pro
A tripeptide composed of L-valine, L-asparagine, and L-proline joined by peptide linkages.
1-[1-(2-Fluorophenyl)-2,5-dimethyl-3-pyrrolyl]-2-(4-methyl-1-piperidinyl)ethanone
N-[3-(N-ethylanilino)propyl]-2,4-dimethyl-6-oxo-3-pyrancarboxamide
1-Tert-butyl-5-[(4-fluoro-2,6-dimethylphenyl)methyl]-4-pyrazolo[3,4-d]pyrimidinone
N1-[2-(1H-indol-3-yl)ethyl]-N3-pyridin-4-ylbenzene-1,3-diamine
1-[(2,2-dimethyl-3H-benzofuran-7-yl)oxy]-3-(2-pyridinylmethylamino)-2-propanol
N-[(2R,3S,6S)-6-[2-(dimethylamino)-2-oxoethyl]-2-(hydroxymethyl)oxan-3-yl]oxane-4-carboxamide
N-[(2R,3R,6R)-6-[2-(dimethylamino)-2-oxoethyl]-2-(hydroxymethyl)oxan-3-yl]oxane-4-carboxamide
N-[(2R,3S,6R)-6-[2-(dimethylamino)-2-oxoethyl]-2-(hydroxymethyl)oxan-3-yl]oxane-4-carboxamide
N-[(2S,3R,6R)-6-[2-(dimethylamino)-2-oxoethyl]-2-(hydroxymethyl)oxan-3-yl]oxane-4-carboxamide
N-[(2S,3S,6S)-6-[2-(dimethylamino)-2-oxoethyl]-2-(hydroxymethyl)-3-oxanyl]-4-oxanecarboxamide
N-[(2S,3R,6S)-6-[2-(dimethylamino)-2-oxoethyl]-2-(hydroxymethyl)-3-oxanyl]-4-oxanecarboxamide
N-[(2R,3R,6S)-6-[2-(dimethylamino)-2-oxoethyl]-2-(hydroxymethyl)-3-oxanyl]-4-oxanecarboxamide
N-[(2S,3R,6R)-2-(hydroxymethyl)-6-[2-oxo-2-(1-piperidinyl)ethyl]-3-oxanyl]-2-methoxyacetamide
N-[(2S,3S,6S)-2-(hydroxymethyl)-6-[2-oxo-2-(1-piperidinyl)ethyl]-3-oxanyl]-2-methoxyacetamide
N-[(2R,3R,6S)-2-(hydroxymethyl)-6-[2-oxo-2-(1-piperidinyl)ethyl]-3-oxanyl]-2-methoxyacetamide
N-[(2S,3S,6R)-6-[2-(dimethylamino)-2-oxoethyl]-2-(hydroxymethyl)-3-oxanyl]-4-oxanecarboxamide
N-[(2R,3S,6R)-2-(hydroxymethyl)-6-[2-oxo-2-(1-piperidinyl)ethyl]-3-oxanyl]-2-methoxyacetamide
N-[(2R,3S,6S)-2-(hydroxymethyl)-6-[2-oxo-2-(1-piperidinyl)ethyl]-3-oxanyl]-2-methoxyacetamide
N-[(2R,3R,6R)-2-(hydroxymethyl)-6-[2-oxo-2-(1-piperidinyl)ethyl]-3-oxanyl]-2-methoxyacetamide
N-[(2S,3S,6R)-2-(hydroxymethyl)-6-[2-oxo-2-(1-piperidinyl)ethyl]-3-oxanyl]-2-methoxyacetamide
N-[(2S,3R,6S)-2-(hydroxymethyl)-6-[2-oxo-2-(1-piperidinyl)ethyl]-3-oxanyl]-2-methoxyacetamide
(4E)-4-[1-(dimethylamino)-2-(4-methylpiperazin-1-yl)ethylidene]-2-phenyl-1,3-oxazol-5-one
2-[hydroxy-[(2R)-2-hydroxy-3-pentoxypropoxy]phosphoryl]oxyethyl-trimethylazanium
(3E,12E)-3,12-dimethyl-8-methylidene-6,18-dioxatricyclo[14.2.1.0,]nonadeca-3,12,16(19)-triene-7,17-dione
2-[Hydroxy-(2-hydroxy-3-pentoxypropoxy)phosphoryl]oxyethyl-trimethylazanium
3-Methyl-5-[5-[4-(4-methyl-4,5-dihydrooxazol-2-yl)phenoxy]pentyl]isoxazole
4,4-Dihydroxy-5,5-diisopropyl-2,2-dimethyl-3,6-biphenyldione
(5R)-5-hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-phenyl-3-heptanone
A beta-hydroxy ketone that is (5R)-5-hydroxyheptan-3-one substituted by a phenyl group at position 1 and a 4-hydroxy-3-methoxyphenyl moiety at position 7. Isolated from Alpinia officinarum, it exhibits antiviral activity against influenza virus.
3-hydroxy-8-(hydroxymethyl)-4b,8-dimethyl-2-(prop-2-en-1-yl)-5,6,7,8a-tetrahydrophenanthrene-1,4-dione
(2z,5s,11r,12s)-12-hydroxy-3,14-dimethyl-11-(prop-1-en-2-yl)-6,16-dioxatricyclo[11.2.1.1⁵,⁸]heptadeca-1(15),2,8(17),13-tetraen-7-one
methyl 4-hydroxy-7,11b-dimethyl-1h,2h,3h,4ah,5h,6h-phenanthro[3,2-b]furan-4-carboxylate
(1r,5as,9as)-10-hydroxy-1,6,6,9a-tetramethyl-1h,2h,5ah,7h,8h,9h-phenanthro[1,2-b]furan-5,11-dione
(2s)-5-[(2r,3s,6e,8r,9r)-3,8-dihydroxy-9-methyl-10-oxo-2,3,4,5,8,9-hexahydrooxecin-2-yl]pentan-2-yl acetate
9-[2-(furan-3-yl)ethyl]-9,10,12-trimethyl-2-oxatricyclo[6.3.1.0⁴,¹²]dodec-4-ene-3,11-dione
3,6,9-trimethylidene-2-oxo-octahydroazuleno[4,5-b]furan-5-yl 2-methylbut-2-enoate
9-hydroxy-12-methoxy-6,6,14-trimethyl-10-oxatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(16),2(7),13(17),14-tetraen-8-one
(2s,4s,5s,11s,12s)-12-hydroxy-4,14-dimethyl-11-(prop-1-en-2-yl)-6,16-dioxatetracyclo[11.2.1.1⁵,⁸.0²,⁴]heptadeca-1(15),8(17),13-trien-7-one
(3z)-3-{2-[(3s,4z)-3-ethyl-3-hydroxy-1-methylpiperidin-4-ylidene]ethylidene}-7-methoxyindol-2-ol
3-hydroxy-5-[(1z,3r)-3-hydroxy-4-methylpent-1-en-1-yl]-2-isopropyl-6-methylnaphthalene-1,4-dione
4-hydroxy-5-isopropyl-1,11,11-trimethyl-8,10-dioxotricyclo[7.3.1.0²,⁷]trideca-2(7),3,5-triene-12-carbaldehyde
(8r,9r,10r,12s)-9-[2-(furan-3-yl)-2-oxoethyl]-9,10,12-trimethyl-2-oxatricyclo[6.3.1.0⁴,¹²]dodec-4-en-3-one
(1s,10s)-24-methyl-3,12,21,24-tetraazahexacyclo[9.7.3.3²,¹⁰.0¹,¹⁰.0⁴,⁹.0¹³,¹⁸]tetracosa-2,4,6,8,11(21),13,15,17-octaene
1-[(4-hydroxyphenyl)methyl]-6,7-dimethoxy-2,2-dimethyl-3,4-dihydro-1h-isoquinolin-2-ium
5-[(2e)-3,7-dimethylocta-2,6-dien-1-yl]-6-hydroxy-1-benzofuran-4-yl acetate
5,11,15,15-tetramethyl-2,7-dioxapentacyclo[8.8.0.0¹,³.0⁴,⁸.0¹¹,¹⁶]octadeca-4,12-diene-6,14-dione
(3s,3br,9bs)-3,6-dihydroxy-7-isopropyl-9b-methyl-3h,3bh,4h,5h,10h,11h-phenanthro[1,2-c]furan-1-one
(1r,2r,6s,7r)-2-[2-(furan-3-yl)-2-oxoethyl]-7-methyl-3-methylidene-9-oxatricyclo[5.3.3.0¹,⁶]tridecan-8-one
(4s,4ar,5s)-3,4a,5-trimethyl-8-oxo-4h,5h,6h,7h-naphtho[2,3-b]furan-4-yl (2z)-2-methylbut-2-enoate
(2r,4as)-2,5-dihydroxy-7-isopropyl-1,1,4a-trimethyl-2,4-dihydrophenanthrene-3,6-dione
8-hydroxy-7-methoxy-5,6-bis(3-methylbut-2-en-1-yl)chromen-2-one
(3r)-15-hydroxy-13-isopropyl-3,7,7-trimethyl-4-oxatricyclo[9.4.0.0³,⁸]pentadeca-1(15),8,10,12-tetraene-5,14-dione
(2z,4e,6e,8e,10e,12e,14e)-2,6,11,15-tetramethylhexadeca-2,4,6,8,10,12,14-heptaenedioic acid
9-[2-(furan-3-yl)-2-oxoethyl]-4,8,10-trimethyl-2-oxatricyclo[6.3.1.0⁴,¹²]dodec-10-en-3-one
(2s)-8-(3-hydroxy-3-methylbutyl)-2-(4-hydroxyphenyl)-3,4-dihydro-2h-1-benzopyran-7-ol
(6s,7r)-4-(acetyloxy)-7-ethenyl-7-methyl-6-(prop-1-en-2-yl)-6,8-dihydro-5h-naphthalen-1-yl acetate
5-(3,7-dimethylocta-2,6-dien-1-yl)-6-hydroxy-1-benzofuran-4-yl acetate
6-[2-(furan-3-yl)-2-oxoethyl]-1,5,6-trimethyl-10-oxatricyclo[7.2.1.0²,⁷]dodec-2(7)-en-11-one
(1r,4as,8ar)-5,5,8a-trimethyl-4-oxo-1-[(1e)-2-(2-oxo-5h-furan-3-yl)ethenyl]-4a,6,7,8-tetrahydro-1h-naphthalene-2-carbaldehyde
(6r)-6-(furan-3-yl)-3-{2-[(1s)-2,6,6-trimethyl-4-oxocyclohex-2-en-1-yl]ethyl}-5,6-dihydropyran-2-one
7-methyl-4-(prop-1-en-2-yl)-10-(propan-2-ylidene)-12-oxabicyclo[9.2.1]tetradeca-1(14),7-diene-6,9,13-trione
(4r,7e,11r)-7-methyl-4-(prop-1-en-2-yl)-10-(propan-2-ylidene)-12-oxabicyclo[9.2.1]tetradeca-1(14),7-diene-6,9,13-trione
(2r,4as,6as,10as,10bs)-2-(furan-3-yl)-6a,7,10b-trimethyl-1h,2h,4ah,5h,6h,10h,10ah-naphtho[2,1-c]pyran-4,9-dione
2,6a-dihydroxy-6-methyl-6-(4-methylpent-3-en-1-yl)-7h,8h-benzo[c]isochromen-9-one
[5-(pentadeca-2,4,6,8,10,12,14-heptaen-1-yl)-1,2-dioxolan-3-yl]acetic acid
4-[(3s,6e)-3-hydroxy-7-(4-hydroxyphenyl)hept-6-en-1-yl]-2-methoxyphenol
(1s,12as,13r,14r,15ar)-14-chloro-1-ethyl-13-hydroxy-1h,4h,5h,6h,7h,8h,9h,10h,12ah,13h,14h,15h,15ah-cyclopenta[c]oxacyclotetradecan-3-one
(1r,7r,9s,10s,11s)-5-isopropyl-12,12-dimethyl-8,17-dioxapentacyclo[8.5.2.0¹,¹¹.0²,⁷.0⁷,⁹]heptadeca-2,5-diene-4,16-dione
24-methyl-3,12,21,24-tetraazahexacyclo[9.7.3.3²,¹⁰.0¹,¹⁰.0⁴,⁹.0¹³,¹⁸]tetracosa-2,4,6,8,11(21),13,15,17-octaene
(4bs,8s,8ar)-3-hydroxy-8-(hydroxymethyl)-4b,8-dimethyl-2-(prop-2-en-1-yl)-5,6,7,8a-tetrahydrophenanthrene-1,4-dione
9-hydroxy-10-(4-hydroxypentyl)-3-methyl-2-oxo-3,4,7,8,9,10-hexahydrooxecin-4-yl acetate
{2-[(2,3-dimethylphenyl)methyl]-4-methylfuran-3-yl}methyl 4-hydroxypent-3-enoate
1-myrtenol
{"Ingredient_id": "HBIN002821","Ingredient_name": "1-myrtenol","Alias": "NA","Ingredient_formula": "C24H24O","Ingredient_Smile": "CC1(C2CC=C(C1C2)C(C3=C4C=CC=CC4=CC5=CC=CC=C53)O)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "33352","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
3β-acetoxy,5α,11,12,13-tetrahydroxy-eudesm-4(15)-ene
{"Ingredient_id": "HBIN008147","Ingredient_name": "3\u03b2-acetoxy,5\u03b1,11,12,13-tetrahydroxy-eudesm-4(15)-ene","Alias": "NA","Ingredient_formula": "C17H28O6","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "287","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
