Exact Mass: 459.1579176
Exact Mass Matches: 459.1579176
Found 334 metabolites which its exact mass value is equals to given mass value 459.1579176
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
5-Methyltetrahydrofolic acid
5 methyltetrahydrofolic acid (5-MTHF) is the most biologically active form of the B-vitamin known as folic acid, also known generically as folate. 5-MTHF functions, in concert with vitamin B12, as a methyl-group donor involved in the conversion of the amino acid homocysteine to methionine. Methyl (CH3) group donation is vital to many bodily processes, including serotonin, melatonin, and DNA synthesis. Therapeutically, 5-MTHF is instrumental in reducing homocysteine levels, preventing neural tube defects, and improving vascular endothelial function. Research on folate supplementation suggests it plays a key role in preventing cervical dysplasia and protecting against neoplasia in ulcerative colitis. Folic acid also shows promise as part of a nutritional protocol to treat vitiligo, and may reduce inflammation of the gingiva. Furthermore, certain neurological, cognitive, and psychiatric presentations may be secondary to folate deficiency. Such presentations include depression, peripheral neuropathy, myelopathy, restless legs syndrome, insomnia, dementia, forgetfulness, irritability, endogenous depression, organic psychosis, and schizophrenia-like syndromes. After ingestion, the process of conversion of folic acid to the metabolically active coenzyme forms is relatively complex. Synthesis of the active forms of folic acid requires several enzymes, adequate liver and intestinal function, and adequate supplies of riboflavin (B2), niacin (B3), pyridoxine (B6), zinc, vitamin C, and serine. After formation of the coenzyme forms of the vitamin in the liver, these metabolically active compounds are secreted into the small intestine with bile (the folate enterohepatic cycle), where they are reabsorbed and distributed to tissues throughout the body. Human pharmacokinetic studies indicate folic acid has high bioavailability, with large oral doses of folic acid substantially raising plasma levels in healthy subjects in a time and dose dependent manner. Red blood cells (RBCs) appear to be the storage depot for folic acid, as RBC levels remain elevated for periods in excess of 40 days following discontinuation of supplementation. Folic acid is poorly transported to the brain and rapidly cleared from the central nervous system. The primary methods of elimination of absorbed folic acid are fecal (through bile) and urinary. Despite the biochemical complexity of this process, evidence suggests oral supplementation with folic acid increases the bodys pool of 5-MTHF in healthy individuals. However, enzyme defects, mal-absorption, digestive system pathology, and liver disease can result in impaired ability to activate folic acid. In fact, some individuals have a severe congenital deficiency of the enzyme Methyl tetrahydrofolate reductase (5-MTHFR), which is needed to convert folic acid to 5-MTHF. Milder forms of this enzyme defect likely interact with dietary folate status to determine risk for some disease conditions. In individuals with a genetic defect of this enzyme (whether mild or severe), supplementation with 5- MTHF might be preferable to folic acid supplementation. (PMID: 17176169). 5 methyltetrahydrofolic acid (5-MTHF) is the most biologically active form of the B-vitamin folic acid, also known generically as folate. 5-MTHF functions, in concert with vitamin B12, as a methyl-group donor involved in the conversion of the amino acid homocysteine to methionine. Methyl (CH3) group donation is vital to many bodily processes, including serotonin, melatonin, and DNA synthesis. Therapeutically, 5-MTHF is instrumental in reducing homocysteine levels, preventing neural tube defects, and improving vascular endothelial function. Research on folate supplementation suggests it plays a key role in preventing cervical dysplasia and protecting against neoplasia in ulcerative colitis. Folic acid also shows promise as part of a nutritional protocol to treat vitiligo, and may reduce inflammation of the gingiva. Furthermore, certain neurological, cognitive, and psychiatric presentations may be secondary to folate deficiency. Such presentations include depression, peripheral neuropathy, myelopathy, restless legs syndrome, insomnia, dementia, forgetfulness, irritability, endogenous depression, organic psychosis, and schizophrenia-like syndromes. After ingestion, the process of conversion of folic acid to the metabolically active coenzyme forms is relatively complex. Synthesis of the active forms of folic acid requires several enzymes, adequate liver and intestinal function, and adequate supplies of riboflavin (B2), niacin (B3), pyridoxine (B6), zinc, vitamin C, and serine. After formation of the coenzyme forms of the vitamin in the liver, these metabolically active compounds are secreted into the small intestine with bile (the folate enterohepatic cycle), where they are reabsorbed and distributed to tissues throughout the body. Human pharmacokinetic studies indicate folic acid has high bioavailability, with large oral doses of folic acid substantially raising plasma levels in healthy subjects in a time and dose dependent manner. Red blood cells (RBCs) appear to be the storage depot for folic acid, as RBC levels remain elevated for periods in excess of 40 days following discontinuation of supplementation. Folic acid is poorly transported to the brain and rapidly cleared from the central nervous system. The primary methods of elimination of absorbed folic acid are fecal (through bile) and urinary. Despite the biochemical complexity of this process, evidence suggests oral supplementation with folic acid increases the bodys pool of 5-MTHF in healthy individuals. However, enzyme defects, mal-absorption, digestive system pathology, and liver disease can result in impaired ability to activate folic acid. In fact, some individuals have a severe congenital deficiency of the enzyme Methyl tetrahydrofolate reductase (5-MTHFR), which is needed to convert folic acid to 5-MTHF. Milder forms of this enzyme defect likely interact with dietary folate status to determine risk for some disease conditions. In individuals with a genetic defect of this enzyme (whether mild or severe), supplementation with 5- MTHF might be preferable to folic acid supplementation. (PMID: 17176169) [HMDB] 5-Methyltetrahydrofolic acid (5-Methyl THF) is a biologically active form of folic acid. 5-Methyltetrahydrofolic acid is a methylated derivate of tetrahydrofolate. 5-Methyltetrahydrofolic acid is the predominant natural dietary folate and the principal form of folate in plasma and cerebrospinal fluid[1]. Levomefolic acid (5-MTHF) is an orally active, brain-penetrant natural active form of folic acid and is one of the most widely used folic acid food supplements[1][2].
Doronine
C21H30ClNO8 (459.16598500000003)
Hytrin
C19H30ClN5O6 (459.18845100000004)
C78272 - Agent Affecting Nervous System > C29747 - Adrenergic Agent > C72900 - Adrenergic Antagonist D018377 - Neurotransmitter Agents > D018663 - Adrenergic Agents > D018674 - Adrenergic Antagonists D000089162 - Genitourinary Agents > D064804 - Urological Agents Terazosin hydrochloride dihydrate is a quinazoline derivative and a competitive and orally active α1-adrenoceptor antagonist. Terazosin hydrochloride dihydrate works by relaxing blood vessels and the opening of the bladder. Terazosin hydrochloride dihydrate has the potential for benign prostatic hyperplasia (BPH) and high blood pressure treatment[1][2][3].
5-Methyltetrahydrofolate
COVID info from COVID-19 Disease Map Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS 5-Methyltetrahydrofolic acid (5-Methyl THF) is a biologically active form of folic acid. 5-Methyltetrahydrofolic acid is a methylated derivate of tetrahydrofolate. 5-Methyltetrahydrofolic acid is the predominant natural dietary folate and the principal form of folate in plasma and cerebrospinal fluid[1].
Narceinone
Narceinone is found in opium poppy. Narceinone is an alkaloid from unlanced dried capsules of Papaver somniferum (opium poppy). Alkaloid from unlanced dried capsules of Papaver somniferum (opium poppy). Narceinone is found in opium poppy.
1-(2-Hydroxyphenylamino)-1-deoxy-beta-D-gentiobioside 1,2-carbamate
Trace metabolite of corn. 1-(2-Hydroxyphenylamino)-1-deoxy-beta-D-gentiobioside 1,2-carbamate is found in cereals and cereal products. 1-(2-Hydroxyphenylamino)-1-deoxy-beta-D-gentiobioside 1,2-carbamate is found in cereals and cereal products. Trace metabolite of corn.
Analogue A
C23H23Cl2N3O3 (459.11163880000004)
Apixaban
B - Blood and blood forming organs > B01 - Antithrombotic agents > B01A - Antithrombotic agents > B01AF - Direct factor xa inhibitors C78275 - Agent Affecting Blood or Body Fluid > C263 - Anticoagulant Agent > C173067 - Direct Factor Xa Inhibitor C78275 - Agent Affecting Blood or Body Fluid > C263 - Anticoagulant Agent > C180619 - Direct Oral Anticoagulant D004791 - Enzyme Inhibitors > D011480 - Protease Inhibitors > D015842 - Serine Proteinase Inhibitors D006401 - Hematologic Agents > D000925 - Anticoagulants > D000991 - Antithrombins COVID info from clinicaltrial, clinicaltrials, clinical trial, clinical trials Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS
Diacylglycerol kinase inhibitor i
C27H26FN3OS (459.17805180000005)
D004791 - Enzyme Inhibitors R 59-022 (DKGI-I) is a DGK inhibitor (IC50: 2.8 μM). R 59-022 inhibits the phosphorylation of OAG to OAPA. R 59-022 is a 5-HT Receptor antagonist, and activates protein kinase C (PKC). R 59-022 potentiates thrombin-induced diacylglycerol production in platelets and inhibits phosphatidic acid production in neutrophils[1][2][3][4].
Fenoverine
A - Alimentary tract and metabolism > A03 - Drugs for functional gastrointestinal disorders > A03A - Drugs for functional gastrointestinal disorders D018373 - Peripheral Nervous System Agents > D001337 - Autonomic Agents > D010276 - Parasympatholytics C78272 - Agent Affecting Nervous System > C29698 - Antispasmodic Agent
Levomefolic acid
5-methyl-tetrahydrofolate, also known as 5-methyltetrahydrofolate, (l-glu)-(R)-isomer or L-methylfolate, is a member of the class of compounds known as tetrahydrofolic acids. Tetrahydrofolic acids are heterocyclic compounds based on the 5,6,7,8-tetrahydropteroic acid skeleton conjugated with at least one L-glutamic acid unit. 5-methyl-tetrahydrofolate is practically insoluble (in water) and an extremely strong acidic compound (based on its pKa). 5-methyl-tetrahydrofolate can be found in a number of food items such as radish (variety), millet, devilfish, and babassu palm, which makes 5-methyl-tetrahydrofolate a potential biomarker for the consumption of these food products. 5-Methyltetrahydrofolic acid (5-Methyl THF) is a biologically active form of folic acid. 5-Methyltetrahydrofolic acid is a methylated derivate of tetrahydrofolate. 5-Methyltetrahydrofolic acid is the predominant natural dietary folate and the principal form of folate in plasma and cerebrospinal fluid[1].
Lilly 117018
C27H25NO4S (459.15042100000005)
D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006727 - Hormone Antagonists > D020847 - Estrogen Receptor Modulators D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006727 - Hormone Antagonists > D004965 - Estrogen Antagonists
Methyltetrahydrofolate
Methyltetrahydrofolic acid
4-hydroxy-2-nonenal-glutathione conjugate
C19H29N3O8S (459.16752740000004)
4-hydroxy-2-nonenal-glutathione conjugate is a member of the class of compounds known as oligopeptides. Oligopeptides are organic compounds containing a sequence of between three and ten alpha-amino acids joined by peptide bonds. 4-hydroxy-2-nonenal-glutathione conjugate is practically insoluble (in water) and a moderately acidic compound (based on its pKa). 4-hydroxy-2-nonenal-glutathione conjugate can be found in a number of food items such as vanilla, kale, beech nut, and summer grape, which makes 4-hydroxy-2-nonenal-glutathione conjugate a potential biomarker for the consumption of these food products.
Apixaban
B - Blood and blood forming organs > B01 - Antithrombotic agents > B01A - Antithrombotic agents > B01AF - Direct factor xa inhibitors C78275 - Agent Affecting Blood or Body Fluid > C263 - Anticoagulant Agent > C173067 - Direct Factor Xa Inhibitor C78275 - Agent Affecting Blood or Body Fluid > C263 - Anticoagulant Agent > C180619 - Direct Oral Anticoagulant D004791 - Enzyme Inhibitors > D011480 - Protease Inhibitors > D015842 - Serine Proteinase Inhibitors D006401 - Hematologic Agents > D000925 - Anticoagulants > D000991 - Antithrombins COVID info from clinicaltrial, clinicaltrials, clinical trial, clinical trials Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS
6-hydroxy-galanthindole 6-O-beta-D-glucopyranoside|6-hydroxy-galanthindolyloside A
6-{[6-(2-Dimethylamino-aethyl)-4-methoxy-benzo[1,3]dioxol-5-yl]-acetyl}-2,3-dimethoxy-benzoesaeure-methylester|6-{[6-(2-dimethylamino-ethyl)-4-methoxy-benzo[1,3]dioxol-5-yl]-acetyl}-2,3-dimethoxy-benzoic acid methyl ester|longicine|narceine methyl ester
rel-(5aR,6R,12S,14aR)-12-[(1R)-1,2-dihydroxy-2-methylpropyl]-1,2,3,5a,6,11,12,14a-octahydro-5a-hydroxy-6,9-dimethoxy-5H,14H-pyrrolo[1,2:4,5]pyrazino[1,2:1,6]pyrido[3,4-b]indole-5,14-dione|rel-(8S,19S)-19,20-dihydro-9,19,20-trihydroxy-8-methoxy-9-epi-fumitremorgin C
2-Deoxydadenosine,9CI,8CI-3,5-dibenzoyl
C24H21N5O5 (459.15426160000004)
R 59-022
C27H26FN3OS (459.17805180000005)
D004791 - Enzyme Inhibitors R 59-022 (DKGI-I) is a DGK inhibitor (IC50: 2.8 μM). R 59-022 inhibits the phosphorylation of OAG to OAPA. R 59-022 is a 5-HT Receptor antagonist, and activates protein kinase C (PKC). R 59-022 potentiates thrombin-induced diacylglycerol production in platelets and inhibits phosphatidic acid production in neutrophils[1][2][3][4].
Clemastine fumarate
C25H30ClNO5 (459.18124000000006)
D018377 - Neurotransmitter Agents > D018494 - Histamine Agents > D006633 - Histamine Antagonists C308 - Immunotherapeutic Agent > C29578 - Histamine-1 Receptor Antagonist D003879 - Dermatologic Agents > D000982 - Antipruritics D018926 - Anti-Allergic Agents Clemastine (HS-592) fumarate is a selective histamine H1 receptor antagonist. Clemastine fumarate is an antihistamine mainly used for relieving symptoms of allergic reactions primarily by competing with histamine to bind H1 receptors. Anti-inflammatory effects[1][2].
Ala Asn Gln Gln
Ala Gln Asn Gln
Ala Gln Gln Asn
Cys His Asn Ser
Cys His Ser Asn
Cys Asn His Ser
Cys Asn Ser His
Cys Ser His Asn
Cys Ser Asn His
Asp Asp Asn Pro
C17H25N5O10 (459.16013499999997)
Asp Asp Pro Asn
C17H25N5O10 (459.16013499999997)
Asp Asn Asp Pro
C17H25N5O10 (459.16013499999997)
Asp Asn Pro Asp
C17H25N5O10 (459.16013499999997)
Asp Pro Asp Asn
C17H25N5O10 (459.16013499999997)
Asp Pro Asn Asp
C17H25N5O10 (459.16013499999997)
Asp Pro Gln Thr
C18H29N5O9 (459.19651840000006)
Asp Pro Thr Gln
C18H29N5O9 (459.19651840000006)
Asp Gln Pro Thr
C18H29N5O9 (459.19651840000006)
Asp Gln Thr Pro
C18H29N5O9 (459.19651840000006)
Asp Thr Pro Gln
C18H29N5O9 (459.19651840000006)
Asp Thr Gln Pro
C18H29N5O9 (459.19651840000006)
Glu Asn Pro Thr
C18H29N5O9 (459.19651840000006)
Glu Asn Thr Pro
C18H29N5O9 (459.19651840000006)
Glu Pro Asn Thr
C18H29N5O9 (459.19651840000006)
Glu Pro Gln Ser
C18H29N5O9 (459.19651840000006)
Glu Pro Ser Gln
C18H29N5O9 (459.19651840000006)
Glu Pro Thr Asn
C18H29N5O9 (459.19651840000006)
Glu Gln Pro Ser
C18H29N5O9 (459.19651840000006)
Glu Gln Ser Pro
C18H29N5O9 (459.19651840000006)
Glu Ser Pro Gln
C18H29N5O9 (459.19651840000006)
Glu Ser Gln Pro
C18H29N5O9 (459.19651840000006)
Glu Thr Asn Pro
C18H29N5O9 (459.19651840000006)
Glu Thr Pro Asn
C18H29N5O9 (459.19651840000006)
Gly Gln Gln Gln
His Cys Asn Ser
His Cys Ser Asn
His Asn Cys Ser
His Asn Ser Cys
His Ser Cys Asn
His Ser Asn Cys
Asn Ala Gln Gln
Asn Cys His Ser
Asn Cys Ser His
Asn Asp Asp Pro
C17H25N5O10 (459.16013499999997)
Asn Asp Pro Asp
C17H25N5O10 (459.16013499999997)
Asn Glu Pro Thr
C18H29N5O9 (459.19651840000006)
Asn Glu Thr Pro
C18H29N5O9 (459.19651840000006)
Asn His Cys Ser
Asn His Ser Cys
Asn Asn Asn Val
Asn Asn Val Asn
Asn Pro Asp Asp
C17H25N5O10 (459.16013499999997)
Asn Pro Glu Thr
C18H29N5O9 (459.19651840000006)
Asn Pro Thr Glu
C18H29N5O9 (459.19651840000006)
Asn Gln Ala Gln
Asn Gln Gln Ala
Asn Ser Cys His
Asn Ser His Cys
Asn Thr Glu Pro
C18H29N5O9 (459.19651840000006)
Asn Thr Pro Glu
C18H29N5O9 (459.19651840000006)
Asn Val Asn Asn
Pro Asp Asp Asn
C17H25N5O10 (459.16013499999997)
Pro Asp Asn Asp
C17H25N5O10 (459.16013499999997)
Pro Asp Gln Thr
C18H29N5O9 (459.19651840000006)
Pro Asp Thr Gln
C18H29N5O9 (459.19651840000006)
Pro Glu Asn Thr
C18H29N5O9 (459.19651840000006)
Pro Glu Gln Ser
C18H29N5O9 (459.19651840000006)
Pro Glu Ser Gln
C18H29N5O9 (459.19651840000006)
Pro Glu Thr Asn
C18H29N5O9 (459.19651840000006)
Pro Asn Asp Asp
C17H25N5O10 (459.16013499999997)
Pro Asn Glu Thr
C18H29N5O9 (459.19651840000006)
Pro Asn Thr Glu
C18H29N5O9 (459.19651840000006)
Pro Gln Asp Thr
C18H29N5O9 (459.19651840000006)
Pro Gln Glu Ser
C18H29N5O9 (459.19651840000006)
Pro Gln Ser Glu
C18H29N5O9 (459.19651840000006)
Pro Gln Thr Asp
C18H29N5O9 (459.19651840000006)
Pro Ser Glu Gln
C18H29N5O9 (459.19651840000006)
Pro Ser Gln Glu
C18H29N5O9 (459.19651840000006)
Pro Thr Asp Gln
C18H29N5O9 (459.19651840000006)
Pro Thr Glu Asn
C18H29N5O9 (459.19651840000006)
Pro Thr Asn Glu
C18H29N5O9 (459.19651840000006)
Pro Thr Gln Asp
C18H29N5O9 (459.19651840000006)
Gln Ala Asn Gln
Gln Ala Gln Asn
Gln Asp Pro Thr
C18H29N5O9 (459.19651840000006)
Gln Asp Thr Pro
C18H29N5O9 (459.19651840000006)
Gln Glu Pro Ser
C18H29N5O9 (459.19651840000006)
Gln Glu Ser Pro
C18H29N5O9 (459.19651840000006)
Gln Gly Gln Gln
Gln Asn Ala Gln
Gln Asn Gln Ala
Gln Pro Asp Thr
C18H29N5O9 (459.19651840000006)
Gln Pro Glu Ser
C18H29N5O9 (459.19651840000006)
Gln Pro Ser Glu
C18H29N5O9 (459.19651840000006)
Gln Pro Thr Asp
C18H29N5O9 (459.19651840000006)
Gln Gln Ala Asn
Gln Gln Gly Gln
Gln Gln Asn Ala
Gln Gln Gln Gly
Gln Ser Glu Pro
C18H29N5O9 (459.19651840000006)
Gln Ser Pro Glu
C18H29N5O9 (459.19651840000006)
Gln Thr Asp Pro
C18H29N5O9 (459.19651840000006)
Gln Thr Pro Asp
C18H29N5O9 (459.19651840000006)
Ser Cys His Asn
Ser Cys Asn His
Ser Glu Pro Gln
C18H29N5O9 (459.19651840000006)
Ser Glu Gln Pro
C18H29N5O9 (459.19651840000006)
Ser His Cys Asn
Ser His Asn Cys
Ser Asn Cys His
Ser Asn His Cys
Ser Pro Glu Gln
C18H29N5O9 (459.19651840000006)
Ser Pro Gln Glu
C18H29N5O9 (459.19651840000006)
Ser Gln Glu Pro
C18H29N5O9 (459.19651840000006)
Ser Gln Pro Glu
C18H29N5O9 (459.19651840000006)
Thr Asp Pro Gln
C18H29N5O9 (459.19651840000006)
Thr Asp Gln Pro
C18H29N5O9 (459.19651840000006)
Thr Glu Asn Pro
C18H29N5O9 (459.19651840000006)
Thr Glu Pro Asn
C18H29N5O9 (459.19651840000006)
Thr Asn Glu Pro
C18H29N5O9 (459.19651840000006)
Thr Asn Pro Glu
C18H29N5O9 (459.19651840000006)
Thr Pro Asp Gln
C18H29N5O9 (459.19651840000006)
Thr Pro Glu Asn
C18H29N5O9 (459.19651840000006)
Thr Pro Asn Glu
C18H29N5O9 (459.19651840000006)
Thr Pro Gln Asp
C18H29N5O9 (459.19651840000006)
Thr Gln Asp Pro
C18H29N5O9 (459.19651840000006)
Thr Gln Pro Asp
C18H29N5O9 (459.19651840000006)
Val Asn Asn Asn
Phe-Trp-OH
C25H21N3O6 (459.14302860000004)
1-(2-Hydroxyphenylamino)-1-deoxy-b-D-gentiobioside 1,2-carbamate
Narceinone
5-Methyl-7-[3-(trifluoromethyl)phenyl]-N-(3,4,5-trimethoxyphenyl)imidazo[5,1-f][1,2,4]triazin-2-amine
C22H20F3N5O3 (459.1518166000001)
2-(2-ethoxy-5-piperidin-1-ylsulfonylphenyl)-5-methyl-7-propyl-1H-imidazo[5,1-f][1,2,4]triazin-4-one
C22H29N5O4S (459.19401540000007)
2-Propanol,1-[(6-chloro-2-methoxy-9-acridinyl)amino]-3-(diethylamino)-, hydrochloride(1:2)
C21H28Cl3N3O2 (459.12469980000003)
(3S,4S)-TERT-BUTYL 3-ETHOXY-4-(2-(3-(TRIFLUOROMETHYL)BENZAMIDO)ACETAMIDO)PYRROLIDINE-1-CARBOXYLATE
C21H28F3N3O5 (459.19809540000006)
A-D-GLUCOPYRANOSIDE,METHYL2-DEOXY-2-[[(PHENYLMETHOXY)CARBONYL]AMINO]-3-O-(PHENYLMETHYL)-,6-ACETATE
Fluazacort
C147908 - Hormone Therapy Agent > C548 - Therapeutic Hormone > C1636 - Therapeutic Steroid Hormone C308 - Immunotherapeutic Agent > C574 - Immunosuppressant > C211 - Therapeutic Corticosteroid
METHYL 3-(3-(TERT-BUTYLTHIO)-1-(4-CHLOROBENZYL)-5-HYDROXY-1H-INDOL-2-YL)-2,2-DIMETHYLPROPANOATE
C25H30ClNO3S (459.16348200000004)
[4-(2,4-difluorophenyl)-2-[(4-methoxyphenyl)carbamoyl]phenyl] benzoate
C27H19F2NO4 (459.12820780000004)
(+/-)-n,n-dimethyl-1-(2-diphenylphosphino)ferrocenylethylamine monohydrate
3-N-FMOC-AMINO-3-(2-T-BUTOXYPHENYL)PROPIONIC ACID
C28H29NO5 (459.20456240000004)
ETHYL 3-(3-(TERT-BUTYLTHIO)-1-(4-CHLOROBENZYL)-5-METHOXY-1H-INDOL-2-YL)-2,2-DIMETHYLPROPANOATE
C25H30ClNO3S (459.16348200000004)
3-N-FMOC-AMINO-3-(3-T-BUTOXYPHENYL)PROPIONIC ACID
C28H29NO5 (459.20456240000004)
AZD-3759
C274 - Antineoplastic Agent > C2189 - Signal Transduction Inhibitor > C129824 - Antineoplastic Protein Inhibitor C274 - Antineoplastic Agent > C163758 - Targeted Therapy Agent > C163952 - EGFR-targeting Agent C471 - Enzyme Inhibitor > C1404 - Protein Kinase Inhibitor > C1967 - Tyrosine Kinase Inhibitor C471 - Enzyme Inhibitor > C129825 - Antineoplastic Enzyme Inhibitor
Pavinetant
C147908 - Hormone Therapy Agent > C547 - Hormone Antagonist > C142789 - Neurokinin-3 Receptor Antagonist Pavinetant (MLE-4901) is a neurokinin-3 receptor (NK3R) antagonist.
Nitrocycline
C21H21N3O9 (459.12777360000007)
C784 - Protein Synthesis Inhibitor > C1595 - Tetracycline Antibiotic C254 - Anti-Infective Agent > C258 - Antibiotic
Fenoverine
A - Alimentary tract and metabolism > A03 - Drugs for functional gastrointestinal disorders > A03A - Drugs for functional gastrointestinal disorders D018373 - Peripheral Nervous System Agents > D001337 - Autonomic Agents > D010276 - Parasympatholytics C78272 - Agent Affecting Nervous System > C29698 - Antispasmodic Agent
(2S)-2-[[4-[(2-amino-4-oxo-5,6,7,8-tetrahydro-3H-pteridin-6-yl)methyl-methylamino]benzoyl]amino]pentanedioic acid
2-[[4-[(2-amino-4-oxo-5,6,7,8-tetrahydro-3H-pteridin-6-yl)methylamino]benzoyl]amino]-5-methoxy-5-oxopentanoic acid
5-chloro-N-[3-(2-chlorophenyl)-1-(4-hydroxypiperidin-1-yl)-1-oxopropan-2-yl]-1H-indole-2-carboxamide
C23H23Cl2N3O3 (459.11163880000004)
[3,5-bis(difluoromethyl)-5-hydroxy-4H-pyrazol-1-yl]-[2-(4-propan-2-ylphenyl)-4-quinolinyl]methanone
(Z)-4-(1,3-benzothiazol-2-yl)-5-[4-(N-methylanilino)-3-nitrophenyl]-4-pentenoic acid
C25H21N3O4S (459.1252706000001)
N-{2-[4-(4-chlorobenzoyl)-1-piperazinyl]phenyl}-1-benzofuran-2-carboxamide
N-(3-methoxyphenyl)-2-[(4-oxo-3-propyl-2-quinazolinyl)thio]-2-phenylacetamide
1-[2-furanyl(oxo)methyl]-N-[4-[(3-methyl-1-piperidinyl)sulfonyl]phenyl]-4-piperidinecarboxamide
C23H29N3O5S (459.18278240000006)
3-(4-Butyl-3-oxo-2-quinoxalinyl)propanoic acid [2-(3-chloro-4-fluoroanilino)-2-oxoethyl] ester
C23H23ClFN3O4 (459.13610400000005)
4-[(2-Methoxyphenyl)-methylsulfamoyl]benzoic acid [2-[(5-methyl-3-isoxazolyl)amino]-2-oxoethyl] ester
C21H21N3O7S (459.11001560000005)
1-[(4-fluorophenyl)methyl]-N-[4-(4-methyl-1-piperazinyl)phenyl]-2-oxo-3H-benzimidazole-5-carboxamide
(E)-1-[4-(4-fluorophenyl)piperazin-1-yl]-3-(4-morpholin-4-ylsulfonylphenyl)prop-2-en-1-one
C23H26FN3O4S (459.1627968000001)
(6R,7R,8R)-N-(3-fluorophenyl)-8-(hydroxymethyl)-7-[4-(2-methylphenyl)phenyl]-2-oxo-1,4-diazabicyclo[4.2.0]octane-4-carboxamide
6,7-Dimethoxy-2-[4-(tetrahydrofuran-2-ylcarbonyl)piperazin-1-yl]quinazolin-4-amine hydrochloride dihydrate
C19H30ClN5O6 (459.18845100000004)
1-(2,5-difluorophenyl)-3-[(2R,3S,6R)-6-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-2-(hydroxymethyl)oxan-3-yl]urea
C24H27F2N3O4 (459.1969526000001)
N-[2-[(2R,5S,6S)-5-[(4-fluorophenyl)sulfonylamino]-6-(hydroxymethyl)-2-oxanyl]ethyl]-2-(4-morpholinyl)acetamide
C20H30FN3O6S (459.18392520000003)
N-[2-[(2S,5S,6S)-5-[(4-fluorophenyl)sulfonylamino]-6-(hydroxymethyl)oxan-2-yl]ethyl]-2-morpholin-4-ylacetamide
C20H30FN3O6S (459.18392520000003)
1-(2,5-difluorophenyl)-3-[(2S,3R,6S)-6-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-2-(hydroxymethyl)oxan-3-yl]urea
C24H27F2N3O4 (459.1969526000001)
1-(2,5-difluorophenyl)-3-[(2S,3R,6R)-6-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-2-(hydroxymethyl)-3-oxanyl]urea
C24H27F2N3O4 (459.1969526000001)
1-(2,5-difluorophenyl)-3-[(2S,3S,6R)-6-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-2-(hydroxymethyl)-3-oxanyl]urea
C24H27F2N3O4 (459.1969526000001)
N-[2-[(2S,5S,6R)-5-[(4-fluorophenyl)sulfonylamino]-6-(hydroxymethyl)-2-oxanyl]ethyl]-2-(4-morpholinyl)acetamide
C20H30FN3O6S (459.18392520000003)
4-fluoro-N-[(2R)-1-hydroxypropan-2-yl]-N-[(2R,3S)-3-methoxy-2-methyl-4-[methyl(1,3-thiazol-2-ylmethyl)amino]butyl]benzenesulfonamide
4-fluoro-N-[(2R)-1-hydroxypropan-2-yl]-N-[(2S,3R)-3-methoxy-2-methyl-4-[methyl(1,3-thiazol-2-ylmethyl)amino]butyl]benzenesulfonamide
1-(2,5-difluorophenyl)-3-[(2R,3S,6S)-6-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-2-(hydroxymethyl)-3-oxanyl]urea
C24H27F2N3O4 (459.1969526000001)
1-(2,5-difluorophenyl)-3-[(2R,3R,6S)-6-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-2-(hydroxymethyl)-3-oxanyl]urea
C24H27F2N3O4 (459.1969526000001)
N-[2-[(2R,5R,6S)-5-[(4-fluorophenyl)sulfonylamino]-6-(hydroxymethyl)-2-oxanyl]ethyl]-2-(4-morpholinyl)acetamide
C20H30FN3O6S (459.18392520000003)
N-[(2S,3R,6R)-6-[2-[(2-fluorophenyl)sulfonylamino]ethyl]-2-(hydroxymethyl)-3-oxanyl]-2-(4-morpholinyl)acetamide
C20H30FN3O6S (459.18392520000003)
N-[(2R,3R,6R)-6-[2-[(2-fluorophenyl)sulfonylamino]ethyl]-2-(hydroxymethyl)-3-oxanyl]-2-(4-morpholinyl)acetamide
C20H30FN3O6S (459.18392520000003)
N-[(2R,3S,6S)-6-[2-[(2-fluorophenyl)sulfonylamino]ethyl]-2-(hydroxymethyl)-3-oxanyl]-2-(4-morpholinyl)acetamide
C20H30FN3O6S (459.18392520000003)
4-fluoro-N-[(2S)-1-hydroxypropan-2-yl]-N-[(2S,3R)-3-methoxy-2-methyl-4-[methyl(2-thiazolylmethyl)amino]butyl]benzenesulfonamide
4-fluoro-N-[(2R)-1-hydroxypropan-2-yl]-N-[(2S,3S)-3-methoxy-2-methyl-4-[methyl(2-thiazolylmethyl)amino]butyl]benzenesulfonamide
(2R,3R,3aS,9bS)-2-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]-7-(2-fluorophenyl)-3-(hydroxymethyl)-1,2,3,3a,4,9b-hexahydropyrrolo[2,3-a]indolizin-6-one
[(1R)-7-methoxy-2-methyl-1-[(1-methyl-4-imidazolyl)sulfonyl]-1-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,4-piperidine]yl]methanol
C22H29N5O4S (459.19401540000007)
[(1S)-7-methoxy-2-methyl-1-[(1-methyl-4-imidazolyl)sulfonyl]-1-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,4-piperidine]yl]methanol
C22H29N5O4S (459.19401540000007)
(6S,7S,8R)-N-(3-fluorophenyl)-8-(hydroxymethyl)-7-[4-(2-methylphenyl)phenyl]-2-oxo-1,4-diazabicyclo[4.2.0]octane-4-carboxamide
1-(2,5-difluorophenyl)-3-[(2S,3S,6S)-6-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-2-(hydroxymethyl)-3-oxanyl]urea
C24H27F2N3O4 (459.1969526000001)
1-(2,5-difluorophenyl)-3-[(2R,3R,6R)-6-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-2-(hydroxymethyl)-3-oxanyl]urea
C24H27F2N3O4 (459.1969526000001)
N-[2-[(2S,5R,6S)-5-[(4-fluorophenyl)sulfonylamino]-6-(hydroxymethyl)-2-oxanyl]ethyl]-2-(4-morpholinyl)acetamide
C20H30FN3O6S (459.18392520000003)
N-[2-[(2R,5S,6R)-5-[(4-fluorophenyl)sulfonylamino]-6-(hydroxymethyl)-2-oxanyl]ethyl]-2-(4-morpholinyl)acetamide
C20H30FN3O6S (459.18392520000003)
N-[2-[(2R,5R,6R)-5-[(4-fluorophenyl)sulfonylamino]-6-(hydroxymethyl)-2-oxanyl]ethyl]-2-(4-morpholinyl)acetamide
C20H30FN3O6S (459.18392520000003)
N-[(2S,3R,6S)-6-[2-[(2-fluorophenyl)sulfonylamino]ethyl]-2-(hydroxymethyl)-3-oxanyl]-2-(4-morpholinyl)acetamide
C20H30FN3O6S (459.18392520000003)
N-[(2R,3S,6R)-6-[2-[(2-fluorophenyl)sulfonylamino]ethyl]-2-(hydroxymethyl)-3-oxanyl]-2-(4-morpholinyl)acetamide
C20H30FN3O6S (459.18392520000003)
N-[(2S,3S,6S)-6-[2-[(2-fluorophenyl)sulfonylamino]ethyl]-2-(hydroxymethyl)-3-oxanyl]-2-(4-morpholinyl)acetamide
C20H30FN3O6S (459.18392520000003)
N-[(2S,3S,6R)-6-[2-[(2-fluorophenyl)sulfonylamino]ethyl]-2-(hydroxymethyl)-3-oxanyl]-2-(4-morpholinyl)acetamide
C20H30FN3O6S (459.18392520000003)
N-[(2R,3R,6S)-6-[2-[(2-fluorophenyl)sulfonylamino]ethyl]-2-(hydroxymethyl)-3-oxanyl]-2-(4-morpholinyl)acetamide
C20H30FN3O6S (459.18392520000003)
4-fluoro-N-[(2S)-1-hydroxypropan-2-yl]-N-[(2R,3R)-3-methoxy-2-methyl-4-[methyl(2-thiazolylmethyl)amino]butyl]benzenesulfonamide
4-fluoro-N-[(2S)-1-hydroxypropan-2-yl]-N-[(2R,3S)-3-methoxy-2-methyl-4-[methyl(2-thiazolylmethyl)amino]butyl]benzenesulfonamide
(2S,3S,3aR,9bR)-2-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]-7-(2-fluorophenyl)-3-(hydroxymethyl)-1,2,3,3a,4,9b-hexahydropyrrolo[2,3-a]indolizin-6-one
(6S,7S,8S)-N-(3-fluorophenyl)-8-(hydroxymethyl)-7-[4-(2-methylphenyl)phenyl]-2-oxo-1,4-diazabicyclo[4.2.0]octane-4-carboxamide
(6R,7R,8S)-N-(3-fluorophenyl)-8-(hydroxymethyl)-7-[4-(2-methylphenyl)phenyl]-2-oxo-1,4-diazabicyclo[4.2.0]octane-4-carboxamide
(5-fluoro-2,4-dioxo-1H-pyrimidin-6-yl) 1-cyclopropyl-6-fluoro-4-oxo-7-piperazin-1-ylquinoline-3-carboxylate
(S)-2-(4-Chlorophenyl)-2-Pyridin-3-Yl-1-[4-[4-(Trifluoromethyl)phenyl]piperazin-1-Yl]ethanone
C24H21ClF3N3O (459.13251620000005)
5-Methyltetrahydrofolic acid
5-Methyltetrahydrofolic acid (5-Methyl THF) is a biologically active form of folic acid. 5-Methyltetrahydrofolic acid is a methylated derivate of tetrahydrofolate. 5-Methyltetrahydrofolic acid is the predominant natural dietary folate and the principal form of folate in plasma and cerebrospinal fluid[1]. Levomefolic acid (5-MTHF) is an orally active, brain-penetrant natural active form of folic acid and is one of the most widely used folic acid food supplements[1][2].
Lilly 117018
C27H25NO4S (459.15042100000005)
D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006727 - Hormone Antagonists > D020847 - Estrogen Receptor Modulators D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006727 - Hormone Antagonists > D004965 - Estrogen Antagonists
1-(2-Hydroxyphenylamino)-1-deoxy-beta-D-gentiobioside 1,2-carbamate
5-Methyltetrahydrofolic acid
A tetrahydrofolic acid that is 5,6,7,8-tetrahydrofolic acid substituted by a methyl group at position 5.
(6S)-5-methyltetrahydrofolic acid
A 5-methyltetrahydrofolic acid that has 6S-configuration.
CZ415
C22H29N5O4S (459.19401540000007)
CZ415 is a potent and highly selective mTOR inhibitor with a pIC50 of 8.07. CZ415 inhibits mTORC1 and mTORC2 protein complex. CZ415 is a potent and highly selective mTOR inhibitor with a pIC50 of 8.07. CZ415 inhibits mTORC1 and mTORC2 protein complex.
IDH1 Inhibitor 7
IDH1 Inhibitor 7 (Compound 88) is an IDH1 inhibitor with an IC50 of less than 100 nM[1].
KG5
C20H16F3N7OS (459.10890820000003)
KG5 is an orally active dual PDGFRβ and B-Raf allosteric inhibitor. KG5 also inhibits Flt3, KIT and c-Raf. KG5 has anticancer, antiangiogenic activities[1].
2,4-dihydroxy-3-[(1-hydroxy-3-{2-hydroxy-5,9-dimethyl-4-oxo-8-oxatetracyclo[7.2.1.1⁷,¹⁰.0¹,⁶]tridecan-5-yl}propylidene)amino]benzoic acid
(4r,5s,6r)-4,5-dihydroxy-6-[(s)-[(3s,4r,5r)-4-hydroxy-5-(4-hydroxy-2-oxopyrimidin-1-yl)-3-methoxyoxolan-2-yl](c-hydroxycarbonimidoyl)methoxy]-5,6-dihydro-4h-pyran-2-carboxylic acid
C17H21N3O12 (459.11251860000004)
(4s,5s,6s)-4,5-dihydroxy-6-[(r)-[(2s,3s,4r,5r)-4-hydroxy-5-(4-hydroxy-2-oxopyrimidin-1-yl)-3-methoxyoxolan-2-yl](c-hydroxycarbonimidoyl)methoxy]-5,6-dihydro-4h-pyran-2-carboxylic acid
C17H21N3O12 (459.11251860000004)
1-(2-hydroxyphenylamino)-1-deoxy-β-gentio-bioside 1,2-carbamate
{"Ingredient_id": "HBIN000886","Ingredient_name": "1-(2-hydroxyphenylamino)-1-deoxy-\u03b2-gentio-bioside 1,2-carbamate","Alias": "NA","Ingredient_formula": "C19H25NO12","Ingredient_Smile": "C1=CC=C(C(=C1)N2C3C(C(C(C(O3)COC4C(C(C(C(O4)CO)O)O)O)O)O)OC2=O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "10608","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
4-(1-chloroethyl)-4-hydroxy-6,7,14-trimethyl-3,8,17-trioxo-2,9-dioxa-14-azabicyclo[9.5.1]heptadec-11-en-7-yl acetate
C21H30ClNO8 (459.16598500000003)
(1r,2r,12s,15r)-12-[(1r)-1,2-dihydroxy-2-methylpropyl]-1-hydroxy-2,7-dimethoxy-10,13,19-triazapentacyclo[11.7.0.0³,¹¹.0⁴,⁹.0¹⁵,¹⁹]icosa-3(11),4,6,8-tetraene-14,20-dione
(3r,4ar,12bs)-3,7,8,10,12b-pentahydroxy-9,12-dimethoxy-3-[(1r,2r)-1-methylaziridin-2-yl]-2,4,4a,5-tetrahydrotetraphene-1,6-dione
n-[(2s)-2-(4-methoxyphenyl)-2-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}ethyl]-3-phenylprop-2-enimidic acid
(r)-[2-(hydroxymethyl)-3,4-dimethoxyphenyl][(5r)-4-methoxy-6-methyl-2h,5h,7h,8h-[1,3]dioxolo[4,5-g]isoquinolin-5-yl]methyl acetate
(2e)-n-[(2s)-2-(4-methoxyphenyl)-2-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}ethyl]-3-phenylprop-2-enimidic acid
{[(2r,3r,4s,5r,6r)-5-(2-amino-n-methylacetamido)-4-hydroxy-6-{[(7r)-7-hydroxy-5-methyl-4-oxo-3h,3ah,6h,7h,7ah-imidazo[4,5-c]pyridin-2-yl]amino}-2-(hydroxymethyl)oxan-3-yl]oxy}methanimidic acid
methyl 6-(2-{6-[2-(dimethylamino)ethyl]-4-methoxy-2h-1,3-benzodioxol-5-yl}acetyl)-2,3-dimethoxybenzoate
4,11,24,25-tetrahydroxy-25-(1-hydroxyethyl)-16-azahexacyclo[15.7.1.0²,¹⁵.0⁵,¹⁴.0⁷,¹².0¹⁸,²³]pentacosa-2(15),3,5(14),7,9,11,18,20,22-nonaene-6,13-dione
C26H21NO7 (459.13179560000003)
2,4-dihydroxy-3-({1-hydroxy-3-[(1s,5s,8s,9r)-9-hydroxy-9-(hydroxymethyl)-5-methyl-4-oxotricyclo[6.2.2.0¹,⁶]dodec-2-en-5-yl]propylidene}amino)benzoic acid
(1r,4s,6r,7r,11z)-4-[(1r)-1-chloroethyl]-4-hydroxy-6,7,14-trimethyl-3,8,17-trioxo-2,9-dioxa-14-azabicyclo[9.5.1]heptadec-11-en-7-yl acetate
C21H30ClNO8 (459.16598500000003)
{[(2r,3r,4s,5r,6r)-6-{[(3as,7r,7as)-7-hydroxy-5-methyl-4-oxo-3h,3ah,6h,7h,7ah-imidazo[4,5-c]pyridin-2-yl]amino}-5-(2-amino-n-methylacetamido)-4-hydroxy-2-(hydroxymethyl)oxan-3-yl]oxy}methanimidic acid
{[(2s,3r,4r,5r,6r)-6-{[(3as,7r,7as)-7-hydroxy-5-methyl-4-oxo-3h,3ah,6h,7h,7ah-imidazo[4,5-c]pyridin-2-yl]amino}-5-(2-amino-n-methylacetamido)-4-hydroxy-2-(hydroxymethyl)oxan-3-yl]oxy}methanimidic acid
2,4-dihydroxy-3-({1-hydroxy-3-[10-hydroxy-10-(hydroxymethyl)-5-methyl-4-oxotricyclo[7.2.1.0¹,⁶]dodec-2-en-5-yl]propylidene}amino)benzoic acid
(2s)-2-[(4-{[(4-hydroxy-2-imino-5-methyl-1,6,7,8-tetrahydropteridin-6-yl)methyl]amino}phenyl)formamido]pentanedioic acid
{[5-(2-amino-n-methylacetamido)-4-hydroxy-6-({7-hydroxy-5-methyl-4-oxo-3h,3ah,6h,7h,7ah-imidazo[4,5-c]pyridin-2-yl}amino)-2-(hydroxymethyl)oxan-3-yl]oxy}methanimidic acid
(2s,3r,4s,5s,6r)-4,5-dihydroxy-3-(1h-pyrrole-2-carbonyloxy)-6-[(1h-pyrrole-2-carbonyloxy)methyl]oxan-2-yl 1h-pyrrole-2-carboxylate
C21H21N3O9 (459.12777360000007)
(1r,17s,24s,25r)-4,11,24,25-tetrahydroxy-25-[(1r)-1-hydroxyethyl]-16-azahexacyclo[15.7.1.0²,¹⁵.0⁵,¹⁴.0⁷,¹².0¹⁸,²³]pentacosa-2(15),3,5(14),7,9,11,18,20,22-nonaene-6,13-dione
C26H21NO7 (459.13179560000003)
(2r,3s,5s,6s)-6-{[(3s,3ar)-7-chloro-5-(cyanomethyl)-3-hydroxy-3h-cyclopenta[a]inden-3a-yl]oxy}-5-hydroxy-2,3-dimethyl-4-oxooxan-3-yl acetate
C23H22ClNO7 (459.10847320000005)
2,4-dihydroxy-3-({1-hydroxy-3-[(1r,2r,5s,7s,9s)-2-hydroxy-5,9-dimethyl-4-oxo-8-oxatetracyclo[7.2.1.1⁷,¹⁰.0¹,⁶]tridecan-5-yl]propylidene}amino)benzoic acid
(1r,4s,6r,7r,11z)-4-[(1s)-1-chloroethyl]-4-hydroxy-6,7,14-trimethyl-3,8,17-trioxo-2,9-dioxa-14-azabicyclo[9.5.1]heptadec-11-en-7-yl acetate
C21H30ClNO8 (459.16598500000003)
(2s)-n-{[(2r,3s,4r,5r)-5-(6-amino-8-hydroxypurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy(hydroxy)phosphoryl}pyrrolidine-2-carboximidic acid
(1r,4r,6r,7r)-4-[(1r)-1-chloroethyl]-4-hydroxy-6,7,14-trimethyl-3,8,17-trioxo-2,9-dioxa-14-azabicyclo[9.5.1]heptadec-11-en-7-yl acetate
C21H30ClNO8 (459.16598500000003)