Exact Mass: 370.1852256

Calanolide

Calanolide A

D000890 - Anti-Infective Agents > D000998 - Antiviral Agents > D044966 - Anti-Retroviral Agents

NCIOpen2_007383

3,17beta-Dihydroxyestra-1,3,5(10)-trien-6-one diacetate

6-linalyl-2-O,3-dimethylflaviolin

A hydroxy-1,4-naphthoquinone that is 2-O-methylflaviolin in which the hydrogens at positions 3 and 6 are replaced by methyl and linalyl groups respectively.

7-O-Geranyl-2-O,3-dimethylflaviolin

A hydroxy-1,4-naphthoquinone that is 3-methylflaviolin in which the hydroxyl hydrogens at positions 2 and 7 are replaced by methyl and geranyl groups respectively.

Lonicerin

Lonicerine

Licarin C

7-methoxy-3-methyl-5-[(1Z)-prop-1-en-1-yl]-2-(3,4,5-trimethoxyphenyl)-2,3-dihydro-1-benzofuran

Licarin C is found in herbs and spices. Licarin C is isolated from nutmeg. Isolated from nutmeg. Licarin C is found in herbs and spices.

Androsterone sulfate

[(1S,2S,5R,7S,10R,11S,15S)-2,15-dimethyl-14-oxotetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadecan-5-yl]oxidanesulfonic acid

Androsterone sulfate (Andros-S) is the most abundant 5-alpha-reduced androgen metabolite in serum (PMID: 8380602). Androsterone sulfate is clinically recognized as one of the major androgen metabolites found in urine. It is a cognate substrate for human dehydroepiandrosterone sulfotransferase, which catalyzes the transfer of the sulfonate group from 3-phosphoadenosine-5-phosphosulfate to dehydroepiandrosterone (DHEA) (PMID: 14573603). Androsterone sulfate has been identified in the human placenta (PMID: 32033212). Serum dehydroepiandrosterone-sulfate is a classic marker for adrenarche and, subsequently, for the individual hormonal milieu. (PMID 10599744) Dehydroepiandrosterone sulfate is an endogenously produced sex steroid that has been hypothesized to have anti aging effects. (PMID 16960027) It also has been inversely associated with development of atherosclerosis. (PMID 8956025) [HMDB] D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones

Kanzonol R

3-[2-hydroxy-4-methoxy-3-(3-methylbut-2-en-1-yl)phenyl]-5-methoxy-3,4-dihydro-2H-1-benzopyran-7-ol

Kanzonol R is found in herbs and spices. Kanzonol R is a constituent of Glycyrrhiza glabra (licorice). Constituent of Glycyrrhiza glabra (licorice). Kanzonol R is found in tea and herbs and spices.

5a-Dihydrotestosterone sulfate

[(1S,2S,7S,10R,11S,14S,15S)-2,15-dimethyl-5-oxotetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadecan-14-yl]oxidanesulfonic acid

5a-Dihydrotestosterone sulfate is a sulfate derivative of 5a-Dihydrotestosterone produced through phase II metabolism. 5a-dihydrotestosterone (DHT) is a steroid similar to testosterone and androstenedione, that belongs to a class called androgens. DHT is a C19 steroid and possesses androgenic activity. Androgen production takes place mainly in the Leydig cells of the testes. Androgens circulate in the blood bound to proteins, especially sex hormone binding globulin (SHBG) and albumin. A trace amount of these steroids circulate in the unbound form in the blood and are referred to as the free fractions. DHT has at least three times the binding affinity for SHBG than testosterone. About 70\\% of DHT is derived from peripheral conversion of testosterone in males, while most of the DHT is derived from androstenedione in females. (http://www.biosupply.co.uk/doc.php?id=2296) [HMDB] 5a-Dihydrotestosterone sulfate is a sulfate derivative of 5a-Dihydrotestosterone produced through phase II metabolism. 5a-dihydrotestosterone (DHT) is a steroid similar to testosterone and androstenedione, that belongs to a class called androgens. DHT is a C19 steroid and possesses androgenic activity. Androgen production takes place mainly in the Leydig cells of the testes. Androgens circulate in the blood bound to proteins, especially sex hormone binding globulin (SHBG) and albumin. A trace amount of these steroids circulate in the unbound form in the blood and are referred to as the free fractions. DHT has at least three times the binding affinity for SHBG than testosterone. About 70\\% of DHT is derived from peripheral conversion of testosterone in males, while most of the DHT is derived from androstenedione in females.

Etiocholanolone sulfate

[(2S,5R,7R,15S)-2,15-dimethyl-14-oxotetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadecan-5-yl]oxidanesulfonic acid

C22H27ClN2O (370.18118020000003)

Etiocholanolone sulfate is urinary sulfate metabolite of etiocholanolone which is one of the steroid hormone. A human metabolite taken as a putative food compound of mammalian origin [HMDB]

Lorcainide

N-(4-chlorophenyl)-2-phenyl-N-[1-(propan-2-yl)piperidin-4-yl]acetamide

Cardiac dysrhythmia is a heart rate disorder that manifests as an altered cardiac rhythm. It results from either abnormal pacemaker activity or a disturbance in impulse propagation, or both. Arrhythmias can be caused by various conditions including ischemia, hypoxia, pH disruptions, B adrenergic activation, drug interactions or the presence of diseased tissue. These events can trigger the development of ectopic pacemaker in the heart, which emit abnormal impulses at random times during the cardiac cycle. An arrhythmia can present itself as either bradycardia or tachycardia. Untreated arrhythmias may progress to atrial fibrillation or ventricular fibrillation. Treatment is aimed at normalizing cardiac rhythm by altering ion flow across the membrane. Antiarrhythmic agents can reduce arrhythmia related symptoms such as palpitations or syncope; however, they often have a narrow therapeutic index and can also be proarrhythmic. Lorcainide (Lorcainide hydrochloride) is a Class 1c antiarrhythmic agent that is used to help restore normal heart rhythm and conduction in patients with premature ventricular contractions, ventricular tachycardiac and Wolff-Parkinson-White syndrome. Lorcainide was developed by Janssen Pharmaceutica (Belgium) in 1968 under the commercial name Remivox and is designated by code numbers R-15889 or Ro 13-1042/001. It has a half-life of 8.9 +- 2.3 hrs which may be prolonged to 66 hrs in people with cardiac disease. Wolff-Parkinson-White syndrome (WPW) is a pre-excitation syndrome in which individuals are predisposed to supraventricular tachyarrhythmias (rapid and irregular heart beats). People with this condition have an extra or accessory atrioventricular conduction pathway that causes re-entry tachycardia. WPW is characterized by a short PR interval (<0.12 second) and a prolonged, slurred QRS complex (>0.12 seconds). C - Cardiovascular system > C01 - Cardiac therapy > C01B - Antiarrhythmics, class i and iii > C01BC - Antiarrhythmics, class ic C78274 - Agent Affecting Cardiovascular System > C47793 - Antiarrhythmic Agent D002317 - Cardiovascular Agents > D000889 - Anti-Arrhythmia Agents

Epiandrosterone sulfate

[(1S,2S,5S,7S,10R,11S,15S)-2,15-dimethyl-14-oxotetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadecan-5-yl]oxidanesulfonic acid

Epiandrosterone sulfate, also known as (3beta,5alpha)-17-oxoandrostan-3-yl hydrogen sulfate or epiandrosterone sulphuric acid, is a member of the class of compounds known as sulfated steroids. Sulfated steroids are sterol lipids containing a sulfate group attached to the steroid skeleton. Epiandrosterone sulfate is practically insoluble (in water) and an extremely strong acidic compound (based on its pKa). Epiandrosterone sulfate can be synthesized from 5alpha-androstane and synthesized into epiandrosterone. Epiandrosterone sulfate can be found in blood and feces. D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones

4-Androsten-3beta,17beta-diol 3-sulfate

[(1S,2R,5S,10R,11S,14S,15S)-14-hydroxy-2,15-dimethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadec-6-en-5-yl]oxidanesulfonic acid

4-Androsten-3beta,17beta-diol 3-sulfate, also known as androstenediol 3-sulfate, is classified as a member of the sulfated steroids. Sulfated steroids are sterol lipids containing a sulfate group attached to the steroid skeleton. 4-Androsten-3beta,17beta-diol monosulfate was found to be significantly (Bonferroni) associated with rheumatoid arthritis (PMID: 28831053).

4-Androsten-3beta,17beta-diol 17-sulfate

[(1S,2R,5S,10R,11S,14S,15S)-5-hydroxy-2,15-dimethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadec-6-en-14-yl]oxidanesulfonic acid

C19H30O5S (370.181385)

4-Androsten-3beta,17beta-diol 17-sulfate, also known as androstenediol 17-sulfate, is classified as a member of the sulfated steroids. Sulfated steroids are sterol lipids containing a sulfate group attached to the steroid skeleton. 4-Androsten-3beta,17beta-diol monosulfate was found to be significantly (Bonferroni) associated with rheumatoid arthritis (PMID: 28831053).

11-Hydroxyyohimbine

methyl 6,18-dihydroxy-3,13-diazapentacyclo[11.8.0.0^{2,10}.0^{4,9}.0^{15,20}]henicosa-2(10),4(9),5,7-tetraene-19-carboxylate

Androstenediol 3-sulfate

{14-hydroxy-2,15-dimethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadec-7-en-5-yl}oxidanesulfonic acid

Calanolide A

12-hydroxy-6,6,10,11-tetramethyl-4-propyl-6,10,11,12-tetrahydro-2H-1,5,9-trioxatriphenylen-2-one

N-Desethyl Sunitinib

N-[2-(ethylamino)ethyl]-5-[(5-fluoro-2-hydroxy-3H-indol-3-ylidene)methyl]-2,4-dimethyl-1H-pyrrole-3-carboximidic acid

Samidorphan

17-(cyclopropylmethyl)-3,10-dihydroxy-13-oxo-17-azatetracyclo[7.5.3.0^{1,10}.0^{2,7}]heptadeca-2(7),3,5-triene-4-carboxamide

[(3S,8R,9S,10S,13S,14S)-10,13-Dimethyl-17-oxo-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-3-yl] hydrogen sulfate

12-Methoxyechitamidine

(-)-12-Methoxyechitamidine

4-[10-Hydroxygeranyloxy]-5-methylcoumarin acetate

18-Hydroxycoronaridine

20R,21-Dihydroxycoronaridine

(19S)-Hydroxytacamine

4-[4-Hydroxygeranyloxy]-5-methylcoumarin acetate

Malabaricon-D

Dimethylwulignan A1

Didymic acid

3-Hydroxy-7-methoxy-1-pentyl-9-propyldibenzo[b,d]furan-2-carboxylic acid

(3R)-3,4-Dihydro-3-(3-hydroxy-2,4-dimethoxyphenyl)-8-(3-methyl-2-butenyl)-2H-1-benzopyran-7-ol

Ajmalicidine

Humantenirine

(1S,2S,4S,7Z,8S,9S)-7-Ethylidene-1,6-dimethoxyspiro[11-oxa-5-azatricyclo[6.3.1.04,9]dodecane-2,3-indole]-2-one

Unanisoflavan

3- [ 5- (1,1-Dimethyl-2-propenyl) -3-hydroxy-2,4-dimethoxyphenyl ] -3,4-dihydro-2H-1-benzopyran-7-ol

Furaquinocin C

(+)-19-Hydroxy-20-epi-pandoline

(+)-20R-18,19-dihydroxy-pseudovincadifformine

10-Hydroxyheyneanine

11-Hydroxyheyneanine

beta-Yohimbine N-oxide

11-Hydroxyyohimbine

4-[10-Hydroxyneryloxy]-5-methylcoumarin acetate

Echitaminic acid

Isorhynchophyllic acid

Sphaerosin s1

7,3-Dihydroxy-2,4-dimethoxy-8-prenylisoflavan

Nb-Demethylechitamine

N(4)-Demethylechitamine

N(4)-Demethyl-12-methoxyalstogustine

(-)-N(4)-Demethyl-12-methoxyalstogustine

A natural product found in Alstonia spatulata.

11-methoxygelsemamide

(+)-11-Methoxygelsemamide

7(S),16(R),19(E)-isositsirikine oxindole

MEGxp0_000644

lespeflorin C4

C22H26O5

Eburnaphylline

5,7-dihydroxy-3,5-dimethoxy-6-prenylflavan

NSC647943

6-hydroxyhumantenine

caberoline

11-hydroxyrhazimanine

19-(S)-Hydroxydihydrogelsevirine

N-Demethylechitamine

3-hydroxy-16-hydroxymethyl-22-nor-vobasan-17-oic acid methyl ester|Voacarpin

Wallichinin

(19R)-19,20-epoxy-11-methoxy-1-methyl-(2beta,20alphaH)-1,2,19,20-tetrahydro-akuammilan-17-oic acid|11-methoxy-quaternoxine|Caberin|caberine

8-hydroxycannabinolic acid A

3,4-Dimethoxy-3,4-methylenedioxy-7,9-epoxylignan-9-ol

Isosplendoline

coronaridine hydroxyindolenine|heyneanine hydroxyindolenine

ACMC-20c1ke

Deserpidic acid

Amsosinine

12-acetoxypseudopterolide

20-hydroxy-12-methoxy-ibogamine-18-carboxylic acid methyl ester|Voacristin

SCHEMBL18983191

avicennol ethyl ether

ajmalicinine

Alkaloid ND 370

NSC686757

austrobailignan

8-hydroxy-5-methyl-7-(3-methylbut-2-enyl)-9-(2-methyl-1-oxobutyl)-4,5-dihydropyrano[4,3,2-de]chromen-2-one

7-geranyloxy-5-hydroxy-2-methoxy-6-methyl-1,4-naphthoquinone|flaviogeranin

wallichinin|wallichinine

3-(2,4-Dimethoxy-5-(1,1-dimethylallyl)phenyl)-3,4-dihydro-2H-1-benzopyran-7,8-diol

10-hydroxyisositsirikine|methyl (2R)-2-[(2R,3E,12bS)-3-ethylidene-1,2,3,4,6,7,12,12b-octahydro-9-hydroxyindolo[2,3-a]quinolizin-2-yl]-3-hydroxypropanoate

1-(hydroxymethyl)-3-(2-hydroxypropan-2-yl)-2-(5-methoxy-9H-beta-carbolin-1-yl)cyclopentanol

5-Hydroxy-8,8-dimethyl-6-(3-methyl-1-oxobutyl)-4-propyl-2H,8H-benzo[1,2-b:3,4-b]dipyran-2-one|5-hydroxy-8,8-dimethyl-6-(3-methyl-butyryl)-4-propyl-8H-pyrano[2,3-f]chromen-2-one

Austrobailignan 4

Yohimbine pseudoindoxyl

CHEMBL2064611

3-(3-Hydroxy-2,4-dimethoxyphenyl)-7-hydroxy-3,4-dihydro-8-(3-methyl-2-butenyl)-2H-1-benzopyran

Melacarpic acid

Licarin C

(2Z,4E)-2-(3,4-dimethoxybenzylidene)-5-(3,4-dimethoxyphenyl)pent-4-en-1-ol|morinol I

Glyasperin I

15-Hydroxyhumantenine

licarin-D

7,3-dihydroxy-5,5-dimethoxy-8-prenylflavan

1-acetyl-19,21-epoxy-aspidospermidine-16,17-diol|Aspidofendlerin, N-Acetyl-16,17-dihydroxy-aspidoalbidin|Aspidofendlerine

kallolide A acetate

C21H26N2O4

17,23-dihydroxyspermostrychnine

Kopsiyunnanine B

negombin I

8-hydroxy-5-methyl-7-(3-methylbut-2-enyl)-9-(3-methyl-1-oxobutyl)-4,5-dihydropyrano[4,3,2-de]chromen-2-one

16-phenoxy tetranor Prostaglandin A2

9-oxo-15R-hydroxy-16-phenoxy-17,18,19,20-tetranor-prosta-5Z,10,13E-trien-1-oic acid

18β-Hydroxy-3-epi-α-yohimbine

methyl (1R,15S,17R,18R,19S,20S)-17,18-dihydroxy-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carboxylate

18-Beta-hydroxy-3-epi-alpha-yohimbine is a natural product found in Rauvolfia serpentina with data available.

GlyasperinD

1,3-BENZENEDIOL, 4-((3R)-3,4-DIHYDRO-5,7-DIMETHOXY-6-(3-METHYL-2-BUTEN-1-YL)-2H-1-BENZOPYRAN-3-YL)-

Glyasperin D is a member of the class of hydroxyisoflavans that is (R)-isoflavan substituted by hydroxy groups at positions 2 and 4, methoxy groups at positions 5 and 7 and a prenyl group at position 6. It has been isolated from Glycyrrhiza uralensis. It has a role as a plant metabolite. It is a member of hydroxyisoflavans, an aromatic ether and a methoxyisoflavan. Glyasperin D is a natural product found in Glycyrrhiza uralensis and Glycyrrhiza aspera with data available. See also: Glycyrrhiza uralensis Root (part of). A member of the class of hydroxyisoflavans that is (R)-isoflavan substituted by hydroxy groups at positions 2 and 4, methoxy groups at positions 5 and 7 and a prenyl group at position 6. It has been isolated from Glycyrrhiza uralensis.

4-hydroxy-7-methoxy-2,3,8-trimethyl-3-(4-methylpent-3-enyl)-2H-benzo[g][1]benzofuran-6,9-dione

NCGC00384938-01!4-hydroxy-7-methoxy-2,3,8-trimethyl-3-(4-methylpent-3-enyl)-2H-benzo[g][1]benzofuran-6,9-dione

C22H26O5_4-[(3R)-5,7-Dimethoxy-6-(3-methyl-2-buten-1-yl)-3,4-dihydro-2H-chromen-3-yl]-1,3-benzenediol

NCGC00247521-02_C22H26O5_4-[(3R)-5,7-Dimethoxy-6-(3-methyl-2-buten-1-yl)-3,4-dihydro-2H-chromen-3-yl]-1,3-benzenediol

Splendoline

4-hydroxy-7-methoxy-2,3,8-trimethyl-3-(4-methylpent-3-enyl)-2H-benzo[g][1]benzofuran-6,9-dione [IIN-based on: CCMSLIB00000849091]

NCGC00384938-01!4-hydroxy-7-methoxy-2,3,8-trimethyl-3-(4-methylpent-3-enyl)-2H-benzo[g][1]benzofuran-6,9-dione [IIN-based on: CCMSLIB00000849091]

4-hydroxy-7-methoxy-2,3,8-trimethyl-3-(4-methylpent-3-enyl)-2H-benzo[g][1]benzofuran-6,9-dione [IIN-based: Match]

NCGC00384938-01!4-hydroxy-7-methoxy-2,3,8-trimethyl-3-(4-methylpent-3-enyl)-2H-benzo[g][1]benzofuran-6,9-dione [IIN-based: Match]

Ala Pro Pro Ser

(2S)-2-{[(2S)-1-{[(2S)-1-[(2S)-2-aminopropanoyl]pyrrolidin-2-yl]carbonyl}pyrrolidin-2-yl]formamido}-3-hydroxypropanoic acid

Ala Pro Ser Pro

(2S)-1-[(2S)-2-{[(2S)-1-[(2S)-2-aminopropanoyl]pyrrolidin-2-yl]formamido}-3-hydroxypropanoyl]pyrrolidine-2-carboxylic acid

Ala Ser Pro Pro

(2S)-1-{[(2S)-1-[(2S)-2-[(2S)-2-aminopropanamido]-3-hydroxypropanoyl]pyrrolidin-2-yl]carbonyl}pyrrolidine-2-carboxylic acid

Gly Pro Pro Thr

(2S,3R)-2-{[(2S)-1-{[(2S)-1-(2-aminoacetyl)pyrrolidin-2-yl]carbonyl}pyrrolidin-2-yl]formamido}-3-hydroxybutanoic acid

Gly Pro Thr Pro

(2S)-1-[(2S,3R)-2-{[(2S)-1-(2-aminoacetyl)pyrrolidin-2-yl]formamido}-3-hydroxybutanoyl]pyrrolidine-2-carboxylic acid

Gly Thr Pro Pro

(2S)-1-{[(2S)-1-[(2S,3R)-2-(2-aminoacetamido)-3-hydroxybutanoyl]pyrrolidin-2-yl]carbonyl}pyrrolidine-2-carboxylic acid

Pro Ala Pro Ser

(2S)-3-hydroxy-2-{[(2S)-1-[(2S)-2-[(2S)-pyrrolidin-2-ylformamido]propanoyl]pyrrolidin-2-yl]formamido}propanoic acid

Pro Ala Ser Pro

(2S)-1-[(2S)-3-hydroxy-2-[(2S)-2-[(2S)-pyrrolidin-2-ylformamido]propanamido]propanoyl]pyrrolidine-2-carboxylic acid

Pro Gly Pro Thr

(2S,3R)-3-hydroxy-2-{[(2S)-1-{2-[(2S)-pyrrolidin-2-ylformamido]acetyl}pyrrolidin-2-yl]formamido}butanoic acid

Pro Gly Thr Pro

(2S)-1-[(2S,3R)-3-hydroxy-2-{2-[(2S)-pyrrolidin-2-ylformamido]acetamido}butanoyl]pyrrolidine-2-carboxylic acid

Pro Pro Ala Ser

(2S)-3-hydroxy-2-[(2S)-2-{[(2S)-1-{[(2S)-pyrrolidin-2-yl]carbonyl}pyrrolidin-2-yl]formamido}propanamido]propanoic acid

Pro Pro Gly Thr

(2S,3R)-3-hydroxy-2-(2-{[(2S)-1-{[(2S)-pyrrolidin-2-yl]carbonyl}pyrrolidin-2-yl]formamido}acetamido)butanoic acid

Pro Pro Ser Ala

(2S)-2-[(2S)-3-hydroxy-2-{[(2S)-1-{[(2S)-pyrrolidin-2-yl]carbonyl}pyrrolidin-2-yl]formamido}propanamido]propanoic acid

Pro Pro Thr Gly

2-[(2S,3R)-3-hydroxy-2-{[(2S)-1-{[(2S)-pyrrolidin-2-yl]carbonyl}pyrrolidin-2-yl]formamido}butanamido]acetic acid

Pro Ser Ala Pro

(2S)-1-[(2S)-2-[(2S)-3-hydroxy-2-[(2S)-pyrrolidin-2-ylformamido]propanamido]propanoyl]pyrrolidine-2-carboxylic acid

Pro Ser Pro Ala

(2S)-2-{[(2S)-1-[(2S)-3-hydroxy-2-[(2S)-pyrrolidin-2-ylformamido]propanoyl]pyrrolidin-2-yl]formamido}propanoic acid

Pro Thr Gly Pro

(2S)-1-{2-[(2S,3R)-3-hydroxy-2-[(2S)-pyrrolidin-2-ylformamido]butanamido]acetyl}pyrrolidine-2-carboxylic acid

Pro Thr Pro Gly

2-{[(2S)-1-[(2S,3R)-3-hydroxy-2-[(2S)-pyrrolidin-2-ylformamido]butanoyl]pyrrolidin-2-yl]formamido}acetic acid

Ser Ala Pro Pro

(2S)-1-{[(2S)-1-[(2S)-2-[(2S)-2-amino-3-hydroxypropanamido]propanoyl]pyrrolidin-2-yl]carbonyl}pyrrolidine-2-carboxylic acid

Ramiprilat Diketopiperazine

Ser Pro Ala Pro

(2S)-1-[(2S)-2-{[(2S)-1-[(2S)-2-amino-3-hydroxypropanoyl]pyrrolidin-2-yl]formamido}propanoyl]pyrrolidine-2-carboxylic acid

Ser Pro Pro Ala

(2S)-2-{[(2S)-1-{[(2S)-1-[(2S)-2-amino-3-hydroxypropanoyl]pyrrolidin-2-yl]carbonyl}pyrrolidin-2-yl]formamido}propanoic acid

Thr Gly Pro Pro

(2S)-1-{[(2S)-1-{2-[(2S,3R)-2-amino-3-hydroxybutanamido]acetyl}pyrrolidin-2-yl]carbonyl}pyrrolidine-2-carboxylic acid

Thr Pro Gly Pro

(2S)-1-(2-{[(2S)-1-[(2S,3R)-2-amino-3-hydroxybutanoyl]pyrrolidin-2-yl]formamido}acetyl)pyrrolidine-2-carboxylic acid

Thr Pro Pro Gly

2-{[(2S)-1-{[(2S)-1-[(2S,3R)-2-amino-3-hydroxybutanoyl]pyrrolidin-2-yl]carbonyl}pyrrolidin-2-yl]formamido}acetic acid

18-Hydroxyyohimbine

14β-Hydroxyyohimbine

Androsterone sulfate

D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones A steroid sulfate that is the 3-sulfate of androsterone.

5β-Androstan-3α-ol-17-one sulfate

17β-Hydroxy-5α-androstan-3-one sulfate

3alpha-hydroxy-5alpha-androstan-17-one 3-sulfate

ESTRONE HEMISUCCINATE

C20H27NaO5 (370.17560920000005)

sodium chlorovulone II

sodium 4R,12S-dihydroxy-9-oxo-5E,7E,10Z,13Z-prostatetraenoate-cyclo[8,12]

sodium chlorovulone III

sodium 4R,12S-dihydroxy-9-oxo-5E,7Z,10Z,13Z-prostatetraenoate-cyclo[8,12]

C20H27NaO5 (370.17560920000005)

5a-Dihydrotestosterone sulfate

Kanzonol R

3-[2-hydroxy-4-methoxy-3-(3-methylbut-2-en-1-yl)phenyl]-5-methoxy-3,4-dihydro-2H-1-benzopyran-7-ol

C22H27ClN2O (370.18118020000003)

Lorcainide

N-(4-chlorophenyl)-2-phenyl-N-[1-(propan-2-yl)piperidin-4-yl]acetamide

C - Cardiovascular system > C01 - Cardiac therapy > C01B - Antiarrhythmics, class i and iii > C01BC - Antiarrhythmics, class ic C78274 - Agent Affecting Cardiovascular System > C47793 - Antiarrhythmic Agent D002317 - Cardiovascular Agents > D000889 - Anti-Arrhythmia Agents

20:4(5Z,10Z,14Z,17Z)(8OH,9Cl,12OH)

8,12-dihydroxy-9-chloro-5Z,10Z,14Z,17Z-eicosatetraenoic acid

20:4(5Z,9Z,14Z,17Z)(8OH,11Cl,12OH)

8,12-dihydroxy-11-chloro-5Z,9Z,14Z,17Z-eicosatetraenoic acid

ST 19:1;O2;S

3alpha-hydroxy-5alpha-androstan-17-one 3-sulfate

DHT-sulfate

5alpha-dihydrotestosterone 17-sulfate

Etiocholanolone sulfate

[(2S,5R,7R,15S)-2,15-dimethyl-14-oxotetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadecan-5-yl]oxidanesulfonic acid

(3-BOC-AMINO-PIPERIDIN-1-YL)-NAPHTHALEN-2-YL-ACETICACID

C20H26N4OS (370.18272260000003)

Oxypendyl

C78272 - Agent Affecting Nervous System > C29710 - Antipsychotic Agent C78272 - Agent Affecting Nervous System > C267 - Antiemetic Agent

(3aR,4R,5R,6aS)-5-(Benzoyloxy)hexahydro-4-(3-oxo-1-octen-1-yl)-2H-cyclopenta[b]furan-2-one

C18H29BF2O3Si (370.1946977999999)

5-(t-Butyldimethylsiloxy)-2,3-difluorophenylboronic

Urea, N-[2-(1H-benzimidazol-2-yl)ethyl]-N-phenyl-N-(phenylmethyl)- (9CI)

4-[CARBOXY-(2-CHLORO-PHENYL)-METHYL]-PIPERAZINE-1-CARBOXYLICACIDTERT-BUTYLESTERHYDROCHLORIDE

N,N-bis[(1R)-2-hydroxy-1-phenylethyl]-2,2-dimethylpropanediamide

3,6-BIS[(1,1-DIMETHYLETHYL)-9H-FLUOREN-9-YL]CHLORODIMETHYL-SILANE

C23H31ClSi (370.1883436)

(S)-TERT-BUTYL 3-(4-AMINOPHENYL)-2-(((BENZYLOXY)CARBONYL)AMINO)PROPANOATE

2-(4-boc-piperazinyl)-2-(2-naphthalenyl)acetic acid

Ciladopa

DI(CYCLOPROPANE-1,2-DICARBOHYDRAZIDE)TRIHYDRATE

C10H26N8O7 (370.1924366)

(3AR,4R,5R,6AS)-2-OXO-4-((E)-3-OXOOCT-1-EN-1-YL)HEXAHYDRO-2H-CYCLOPENTA[B]FURAN-5-YL BENZOATE

ethyl 4-[3-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]anilino]benzoate

C18H30N2O4S (370.19261800000004)

(S)-ropivacaine

N-(2-Fluoro-5-methylphenyl)-N-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]urea

C20H24BFN2O3 (370.1863916)

Colpormon

3,16alpha-dihydroxyestra-1,3,5(10)-trien-17-one 3,16-diacetate

D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones

quinine formate

N-Desethyl Sunitinib

Samidorphan

D002492 - Central Nervous System Depressants > D009294 - Narcotics > D053610 - Opiate Alkaloids C78272 - Agent Affecting Nervous System > C681 - Opiate Antagonist

Branebrutinib

C471 - Enzyme Inhibitor > C1404 - Protein Kinase Inhibitor > C1967 - Tyrosine Kinase Inhibitor C274 - Antineoplastic Agent > C163758 - Targeted Therapy Agent > C163774 - BTK-targeting Agent D004791 - Enzyme Inhibitors > D047428 - Protein Kinase Inhibitors

Costatolide

D000890 - Anti-Infective Agents > D000998 - Antiviral Agents > D044966 - Anti-Retroviral Agents

Calanolide F

A natural product found in Calophyllum lanigerum var austrocoriaceum and Calophyllum teysmannii var inophylloide. D000890 - Anti-Infective Agents > D000998 - Antiviral Agents > D044966 - Anti-Retroviral Agents

7-Cyclopentyl-5-(4-phenoxyphenyl)-7H-pyrrolo[2,3-d]pyrimidin-4-ylamine

Oxazine 750

C24H24N3O+ (370.1919274)

6-Oxoestradiol diacetate

3,17beta-Dihydroxyestra-1,3,5(10)-trien-6-one diacetate

C18H22N6O3 (370.17533019999996)

1-(Phenylmethyl)-4-(4-phenyl-1-piperazinyl)pyrazolo[3,4-d]pyrimidine

C22H22N6 (370.1905852)

4-{[4-Amino-6-(cyclohexylmethoxy)-5-nitrosopyrimidin-2-YL]amino}benzamide

2,4-Diamino-6-[N-(3,4,5-trimethoxybenzyl)-N-methylamino]pyrido[2,3-D]pyrimidine

C18H22N6O3 (370.17533019999996)

[(3S,8R,9S,10S,13S,14S)-10,13-Dimethyl-17-oxo-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-3-yl] hydrogen sulfate

5beta-Androstan-3alpha-ol-17-one sulfate

Samidorphan

17-(cyclopropylmethyl)-3,10-dihydroxy-13-oxo-17-azatetracyclo[7.5.3.0^{1,10}.0^{2,7}]heptadeca-2(7),3,5-triene-4-carboxamide

4-Androsten-3beta,17beta-diol 17-sulfate

Androstenediol 3-sulfate

(-)-8-Epi-aristoligone

A natural product found in Holostylis reniformis.

6-[(2-fluorophenyl)methyl]-5-methyl-N-(3-methylbutyl)-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide

2-[2-fluoro-5-(4-methyl-1-piperazinyl)-4-nitrophenyl]-3,4-dihydro-1H-isoquinoline

C20H26N4OS (370.18272260000003)

1-cyclohexyl-3-(12-oxo-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazolin-2-yl)thiourea

4-[7-(4-Methylphenyl)-5-phenyl-4-pyrrolo[2,3-d]pyrimidinyl]morpholine

4-[7-(3-Methylphenyl)-5-phenyl-4-pyrrolo[2,3-d]pyrimidinyl]morpholine

1-(4-ethylphenyl)-2-methyl-N-(3-pyridinylmethyl)-5-benzimidazolecarboxamide

Androstenediol sulfate

CID 6325869

C20H26N4OS (370.18272260000003)

2-(3-chloro-4-fluorophenoxy)-N-[(3S)-1-(3,3-dimethylbutyl)-3-piperidinyl]acetamide

C19H28ClFN2O2 (370.182323)

Cyclopropyl-[4-(2,7-dimethyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)-1-piperazinyl]methanone

N-[(2R,3R,6S)-6-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-3-yl]cyclopropanecarboxamide

N-[(2R,3S,6R)-6-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-3-yl]cyclopropanecarboxamide

N-[(2S,3S,6R)-6-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-3-yl]cyclopropanecarboxamide

N-[(2R,3S,6S)-6-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-3-yl]cyclopropanecarboxamide

N-[(2R,3R,6R)-6-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-3-yl]cyclopropanecarboxamide

[(1R,5S)-7-[4-(2-methylphenyl)phenyl]-3,6-diazabicyclo[3.1.1]heptan-3-yl]-(2-pyrazinyl)methanone

N-[(2S,3R,6R)-6-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-3-yl]cyclopropanecarboxamide

N-[(2S,3S,6S)-6-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-3-yl]cyclopropanecarboxamide

(6R,7S,8S)-8-(hydroxymethyl)-4-(2-methoxy-1-oxoethyl)-7-[4-(3-methylbut-1-ynyl)phenyl]-1,4-diazabicyclo[4.2.0]octan-2-one

C20H27NaO5 (370.17560920000005)

sodium 4R,12S-dihydroxy-9-oxo-5E,7Z,10Z,13Z-prostatetraenoate-cyclo[8,12]

[(3R,8R,9S,10R,13S,14S,17R)-3-hydroxy-10,13-dimethyl-2,3,6,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl] hydrogen sulfate

Calanolide A

D000890 - Anti-Infective Agents > D000998 - Antiviral Agents > D044966 - Anti-Retroviral Agents

5alpha-Dihydrotestosterone sulfate

A 3-oxo-5alpha-steroid that is 5alpha-dihydrotestosterone in which the hydroxy hydrogen at position 17 has been replaced by a sulfo group.

Epiandrosterone sulfate

D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones A steroid sulfate that is the 3-sulfate of epiandrosterone.

3-Hydroxy-7-methoxy-1-pentyl-9-propyldibenzo[b,d]furan-2-carboxylic acid

N(4)-Demethylechitamine

A natural product found in Alstonia spatulata.

8,12-dihydroxy-11-chloro-5Z,9Z,14Z,17Z-eicosatetraenoic acid

8,12-dihydroxy-9-chloro-5Z,10Z,14Z,17Z-eicosatetraenoic acid

(+)-calanolide A

An organic heterotetracyclic compound that is 11,12-dihydro-2H,6H,10H-dipyrano[2,3-f:2,3-h]chromen-2-one substituted by a hydroxy group at position 12, methyl groups at positions 6, 6, 10 and 11 and a propyl group at position 4 (the 10R,11S,12S stereoisomer). Isolated from Calophyllum lanigerum var austrocoriaceum and Calophyllum brasiliense, it exhibits potent activity against HIV-1 reverse transcriptase.

(-)-calanolide B

An organic heterotetracyclic compound that is 11,12-dihydro-2H,6H,10H-dipyrano[2,3-f:2,3-h]chromen-2-one substituted by a hydroxy group at position 12, methyl groups at positions 6, 6, 10 and 11 and a propyl group at position 4 (the 10S,11R,12S stereoisomer). Isolated from Calophyllum lanigerum var austrocoriaceum and Calophyllum brasiliense, it exhibits potent activity against HIV-1 reverse transcriptase.

Androstaneolone sulfate

Androstanolone sulfate

Dihydro-testosterone sulfate

ST 22:6;O5

BI-167107

BI-167107 is a high affinity, full agonist that binds to the β2 adrenergic receptor (β2AR) with a dissociation constant Kd of 84 pM[1].

(1'r,3s,4's,7'e,8's,9's)-7'-ethylidene-1,6-dimethoxy-11'-oxa-5'-azaspiro[indole-3,2'-tricyclo[6.3.1.0⁴,⁹]dodecan]-2-one

2-hydroxy-1-{14-hydroxy-16-methyl-15-oxa-1,11-diazahexacyclo[15.3.1.0⁴,¹².0⁴,²⁰.0⁵,¹⁰.0¹³,¹⁸]henicosa-5,7,9-trien-11-yl}ethanone

methyl 2-hydroxy-1'-methyl-1',3',4',4'a,5',5'a,7',8',10',10'a-decahydrospiro[indole-3,6'-pyrano[3,4-f]indolizine]-4'-carboxylate

methyl (1s,15s,18r,19s,20r)-7,18-dihydroxy-3,13-diazapentacyclo[11.8.0.0²,¹⁰.0⁴,⁹.0¹⁵,²⁰]henicosa-2(10),4,6,8-tetraene-19-carboxylate

methyl 2-hydroxy-1'-methyl-1',3',4',4'a,5',6',8',9',10'a,10'b-decahydrospiro[indole-3,10'-pyrano[4,3-g]indolizine]-4'-carboxylate

methyl 17,18-dihydroxy-2,12-diazahexacyclo[14.2.2.1⁹,¹².0¹,⁹.0³,⁸.0¹⁶,²¹]henicosa-3,5,7-triene-18-carboxylate

methyl 17,18-dihydroxy-3,13-diazapentacyclo[11.8.0.0²,¹⁰.0⁴,⁹.0¹⁵,²⁰]henicosa-2(10),4,6,8-tetraene-19-carboxylate

4-hydroxy-7-methoxy-2,3,8-trimethyl-3-(4-methylpent-3-en-1-yl)-2h-naphtho[1,2-b]furan-6,9-dione

methyl (1s,9r,16s,17s,18r,21r)-17,18-dihydroxy-2,12-diazahexacyclo[14.2.2.1⁹,¹².0¹,⁹.0³,⁸.0¹⁶,²¹]henicosa-3,5,7-triene-18-carboxylate

methyl 12-(1-hydroxyethyl)-6-methoxy-8,14-diazapentacyclo[9.5.2.0¹,⁹.0²,⁷.0¹⁴,¹⁷]octadeca-2,4,6,9-tetraene-10-carboxylate

(2s)-2-hydroxy-1-[4-hydroxy-2-methoxy-5-(3-methylbut-2-en-1-yl)phenyl]-3-(4-methoxyphenyl)propan-1-one

2-[(3,4-dimethoxyphenyl)methoxy]-7-methoxy-3-methyl-5-(prop-1-en-1-yl)-2,3-dihydro-1-benzofuran

(15s,17s,19s)-15-ethyl-17-hydroxy-17-(methoxycarbonyl)-1,11-diazapentacyclo[9.6.2.0²,⁷.0⁸,¹⁸.0¹⁵,¹⁹]nonadeca-2,4,6,8(18)-tetraen-11-ium-11-olate

(1r,8s,11r,15s)-6-methyl-2-(2-oxopropyl)-16-oxapentacyclo[13.2.2.0¹,¹³.0³,¹¹.0⁴,⁸]nonadec-9-ene-7,17,18-trione

(2r,3r)-7-methoxy-3-methyl-5-[(1e)-prop-1-en-1-yl]-2-(3,4,5-trimethoxyphenyl)-2,3-dihydro-1-benzofuran

methyl (1r,15s,17r,18r,19s,20r)-17,18-dihydroxy-3,13-diazapentacyclo[11.8.0.0²,¹⁰.0⁴,⁹.0¹⁵,²⁰]henicosa-2(10),4,6,8-tetraene-19-carboxylate

(1r,3r,8s,10s,11s)-4-ethylidene-8-[4-methoxy-2-(methoxyamino)phenyl]-13-oxa-6-azatetracyclo[6.5.0.0³,¹¹.0⁶,¹⁰]tridecan-7-one

(2z)-2-[(3s,6'r,7's,8'as)-6'-ethyl-2-hydroxy-3',5',6',7',8',8'a-hexahydro-2'h-spiro[indole-3,1'-indolizin]-7'-yl]-3-methoxyprop-2-enoic acid

(2r,2ar,4as,6r,7ar,7br)-3-formyl-6,7b-dimethyl-1h,2h,2ah,4ah,5h,6h,7h,7ah-cyclobuta[e]inden-2-yl 2,4-dihydroxy-6-methylbenzoate

methyl (1s,15r,16r,19r,20s)-16-hydroxy-16-methyl-17-oxa-3,13-diazapentacyclo[11.8.0.0²,¹⁰.0⁴,⁹.0¹⁵,²⁰]henicosa-2(10),4,6,8-tetraene-19-carboxylate

(2s,3s,4r,6r,8s,11s)-6-methyl-2-(2-oxopropyl)-16-oxapentacyclo[13.2.2.0¹,¹³.0³,¹¹.0⁴,⁸]nonadec-9-ene-7,17,18-trione

(1s,15r,18s,19r,20r)-18-hydroxy-19-(methoxycarbonyl)-3,13-diazapentacyclo[11.8.0.0²,¹⁰.0⁴,⁹.0¹⁵,²⁰]henicosa-2(10),4,6,8-tetraen-13-ium-13-olate

(3s)-3-[3-hydroxy-2,4-dimethoxy-5-(2-methylbut-3-en-2-yl)phenyl]-3,4-dihydro-2h-1-benzopyran-7-ol

11-hydroxyhumantenine

{"Ingredient_id": "HBIN000446","Ingredient_name": "11-hydroxyhumantenine","Alias": "NA","Ingredient_formula": "C21H26N2O4","Ingredient_Smile": "CC=C1CN(C2CC3(C4CC1C2CO4)C5=C(C=C(C=C5)O)N(C3=O)OC)C","Ingredient_weight": "370.4 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "10167","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "102004537","DrugBank_id": "NA"}

15-hydroxyhumamtenine

{"Ingredient_id": "HBIN001688","Ingredient_name": "15-hydroxyhumamtenine","Alias": "NA","Ingredient_formula": "C21H26N2O4","Ingredient_Smile": "CC=C1CN(C2CC3(C4CC1(C2CO4)O)C5=CC=CC=C5N(C3=O)OC)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "31201","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

15-hydroxyhumantenine

{"Ingredient_id": "HBIN001689","Ingredient_name": "15-hydroxyhumantenine","Alias": "NA","Ingredient_formula": "C21H26N2O4","Ingredient_Smile": "CC=C1CN(C2CC3(C4CC1(C2CO4)O)C5=CC=CC=C5N(C3=O)OC)C","Ingredient_weight": "370.4 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "10168","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "101606434","DrugBank_id": "NA"}

19-(r)-hydroxydihydrogelsevirine

{"Ingredient_id": "HBIN002215","Ingredient_name": "19-(r)-hydroxydihydrogelsevirine","Alias": "NA","Ingredient_formula": "C21H26N2O4","Ingredient_Smile": "CC(C12CN(C3C1C4(C5CC2C3CO5)C6=CC=CC=C6N(C4=O)OC)C)O","Ingredient_weight": "370.4 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "10000","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "101601180","DrugBank_id": "NA"}

19-(s)-hydroxydihydrogelsevirine

{"Ingredient_id": "HBIN002221","Ingredient_name": "19-(s)-hydroxydihydrogelsevirine","Alias": "NA","Ingredient_formula": "C21H26N2O4","Ingredient_Smile": "CC(C12CN(C3C1C4(C5CC2C3CO5)C6=CC=CC=C6N(C4=O)OC)C)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "10001","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

6-allyl-7-(3,4-dimethoxyphenyl)-2,3-dimethoxy-8-methyl-tricyclo[4.2.0.02,8]oct-3-en-5-one

{"Ingredient_id": "HBIN012182","Ingredient_name": "6-allyl-7-(3,4-dimethoxyphenyl)-2,3-dimethoxy-8-methyl-tricyclo[4.2.0.02,8]oct-3-en-5-one","Alias": "NA","Ingredient_formula": "C22H26O5","Ingredient_Smile": "CC12C(C3(C1C2(C(=CC3=O)OC)OC)CC=C)C4=CC(=C(C=C4)OC)OC","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "946","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

amsosinine

{"Ingredient_id": "HBIN015914","Ingredient_name": "amsosinine","Alias": "NA","Ingredient_formula": "C21H26N2O4","Ingredient_Smile": "CC1(C2CN3CCC4=C(C3CC2C(CO1)C(=O)OC)NC5=CC=CC=C45)O","Ingredient_weight": "370.4 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "1089","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "5318152","DrugBank_id": "NA"}

aspidodasycarpine