Exact Mass: 470.3066
Exact Mass Matches: 470.3066
Found 500 metabolites which its exact mass value is equals to given mass value 470.3066,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Glycyrrhetinic acid
Glycyrrhetinic acid is a pentacyclic triterpenoid that is olean-12-ene substituted by a hydroxy group at position 3, an oxo group at position 11 and a carboxy group at position 30. It has a role as an immunomodulator and a plant metabolite. It is a pentacyclic triterpenoid, a cyclic terpene ketone and a hydroxy monocarboxylic acid. It is a conjugate acid of a glycyrrhetinate. It derives from a hydride of an oleanane. Enoxolone (glycyrrhetic acid) has been investigated for the basic science of Apparent Mineralocorticoid Excess (AME). Enoxolone is a natural product found in Glycyrrhiza, Echinopora lamellosa, and other organisms with data available. Enoxolone is a pentacyclic triterpenoid aglycone metabolite of glycyrrhizin, which is a product of the plant Glycyrrhiza glabra (licorice), with potential expectorant, and gastrokinetic activities. After administration, enoxolone inhibits the metabolism of prostaglandins by both 15-hydroxyprostaglandin dehydrogenase [NAD(+)] and prostaglandin reductase 2. Therefore, this agent potentiates the activity of prostaglandin E2 and F2alpha, which inhibits gastric secretion while stimulating pancreatic secretion and the secretion of intestinal and respiratory mucus, leading to increased intestinal motility and antitussive effects. Additionally, this agent inhibits 11 beta-hydroxysteroid dehydrogenase and other enzymes involved in the conversion of cortisol to cortisone in the kidneys. An oleanolic acid from GLYCYRRHIZA that has some antiallergic, antibacterial, and antiviral properties. It is used topically for allergic or infectious skin inflammation and orally for its aldosterone effects in electrolyte regulation. See also: Glycyrrhizin (is active moiety of); Glycyrrhiza Glabra (part of). Glycyrrhetinic acid is a pentacyclic triterpenoid derivative of the beta-amyrin type obtained from the hydrolysis of glycyrrhizic acid, which was first obtained from the herb liquorice. It is used in flavouring and it masks the bitter taste of drugs like aloe and quinine. It is effective in the treatment of peptic ulcer and also has expectorant (antitussive) properties (PMID:32106571). In glycyrrhetinic acid the functional group (R) is a hydroxyl group. Research in 2005 demonstrated that with a proper functional group a very effective glycyrrhetinic artificial sweetener can be obtained. When R is an anionic NHCO(CH2)CO2K side chain, the sweetening effect is found to 1200 times that of sugar (human sensory panel data). A shorter or longer spacer reduces the sweetening effect. One explanation is that the taste bud cell receptor has 1.3 nanometers (13 angstroms) available for docking with the sweetener molecule. In addition the sweetener molecule requires three proton donor positions of which two reside at the extremities to be able to interact efficiently with the receptor cavity. 18α-Glycyrrhetinic acid, a diet-derived compound, is an inhibitor of NF-kB and an activator of proteasome, which serves as pro-longevity and anti-aggregation factor in a multicellular organism. 18α-Glycyrrhetinic acid induces apoptosis[1][2]. 18α-Glycyrrhetinic acid, a diet-derived compound, is an inhibitor of NF-kB and an activator of proteasome, which serves as pro-longevity and anti-aggregation factor in a multicellular organism. 18α-Glycyrrhetinic acid induces apoptosis[1][2]. 18β-Glycyrrhetinic acid is the major bioactive component of Glycyrrhiza uralensis and possesses anti-ulcerative, anti-inflammatory and antiproliferative properties. 18β-Glycyrrhetinic acid is the major bioactive component of Glycyrrhiza uralensis and possesses anti-ulcerative, anti-inflammatory and antiproliferative properties.
Gypsogenin
Gypsogenin is a sapogenin that is olean-12-en-28-oic acid substituted by a beta-hydroxy group at position 3 and an oxo group at position 23. It is a pentacyclic triterpenoid, a sapogenin, an aldehyde and a monocarboxylic acid. It is functionally related to an oleanolic acid. It is a conjugate acid of a gypsogenin(1-). Gypsogenin is a natural product found in Silene firma, Gypsophila bicolor, and other organisms with data available. Gypsogenin shows antiangiogenic activity and the significant cytotoxicity against H460[1]. Gypsogenin shows antiangiogenic activity and the significant cytotoxicity against H460[1].
11-Keto-beta-boswellic acid
11-Keto-beta-boswellic acid is a natural product found in Boswellia papyrifera, Boswellia sacra, and Boswellia serrata with data available. See also: Indian frankincense (part of). 11-Keto-beta-boswellic acid is found in herbs and spices. 11-Keto-beta-boswellic acid is a constituent of Boswellia serrata (Indian olibanum). Constituent of Boswellia serrata (Indian olibanum). 11-Keto-beta-boswellic acid is found in herbs and spices. 11-Keto-beta-boswellic acid (11-Keto-β-boswellic acid) is a pentacyclic triterpenic acid of the oleogum resin from the bark of the Boswellia serrate tree, popularly known as Indian Frankincense. 11-Keto-beta-boswellic acid has the anti-inflammatory activity is primarily due to inhibit 5-lipoxygenase (5-LOX) and subsequent leukotriene and nuclear factor-kappa B (NF-κB) activation and tumor necrosis factor alpha generation production[1]. 11-Keto-beta-boswellic acid (11-Keto-β-boswellic acid) is a pentacyclic triterpenic acid of the oleogum resin from the bark of the Boswellia serrate tree, popularly known as Indian Frankincense. 11-Keto-beta-boswellic acid has the anti-inflammatory activity is primarily due to inhibit 5-lipoxygenase (5-LOX) and subsequent leukotriene and nuclear factor-kappa B (NF-κB) activation and tumor necrosis factor alpha generation production[1]. 11-Keto-beta-boswellic acid (11-Keto-β-boswellic acid) is a pentacyclic triterpenic acid of the oleogum resin from the bark of the Boswellia serrate tree, popularly known as Indian Frankincense. 11-Keto-beta-boswellic acid has the anti-inflammatory activity is primarily due to inhibit 5-lipoxygenase (5-LOX) and subsequent leukotriene and nuclear factor-kappa B (NF-κB) activation and tumor necrosis factor alpha generation production[1].
Pomonic acid
Pomonic acid is a triterpenoid. Pomonic acid is a natural product found in Lantana strigocamara with data available. Pomonic acid is found in pomes. Pomonic acid is isolated as the Me ester from apple (Pyrus malus Isol. as the Me ester from apple (Pyrus malus). Pomonic acid is found in pomes.
Ganodermic acid Jb
Ganodermic acid Ja is found in mushrooms. Ganodermic acid Ja is a metabolite of Ganoderma lucidum (reishi). Ganodermic acid Jb is a triterpenoid.
Colubrinic acid
Colubrinic acid is found in fruits. Colubrinic acid is a constituent of Zizyphus jujuba (Chinese date). Constituent of Zizyphus jujuba (Chinese date). Colubrinic acid is found in fruits.
28-Hydroxymangiferonic acid
28-Hydroxymangiferonic acid is found in fruits. 28-Hydroxymangiferonic acid is a constituent of Mangifera indica (mango). Constituent of Mangifera indica (mango). 28-Hydroxymangiferonic acid is found in fruits.
Secobryononic acid
Secobryononic acid is found in fruits. Secobryononic acid is a constituent of Sandoricum koetjape (santol). Constituent of Sandoricum koetjape (santol). Secobryononic acid is found in fruits.
Rubinic acid
Rubinic acid is found in fruits. Rubinic acid is a constituent of Rubus fruticosus (blackberry). Constituent of Rubus fruticosus (blackberry). Rubinic acid is found in fruits.
Ganoderiol B
Ganoderiol B is found in mushrooms. Ganoderiol B is a constituent of Ganoderma lucidum (reishi). Constituent of Ganoderma lucidum (reishi). Ganoderiol B is found in mushrooms.
23-Hydroxy-3-oxocycloart-24-en-26-oic acid
23-Hydroxy-3-oxocycloart-24-en-26-oic acid is found in fruits. 23-Hydroxy-3-oxocycloart-24-en-26-oic acid is a constituent of Mangifera indica (mango) Constituent of Mangifera indica (mango). 23-Hydroxy-3-oxocycloart-24-en-26-oic acid is found in fruits.
6beta-Hydroxy-3-oxo-12-oleanen-28-oic acid
6beta-Hydroxy-3-oxo-12-oleanen-28-oic acid is a constituent of Myroxylon balsamum (Tolu balsam) Constituent of Myroxylon balsamum (Tolu balsam)
Koetjapic acid
Koetjapic acid is found in fruits. Koetjapic acid is a constituent of Sandoricum koetjape (santol). Constituent of Sandoricum koetjape (santol). Koetjapic acid is found in fruits.
(3alpha,20R,24Z)-3-Hydroxy-21-oxoeupha-8,24-dien-26-oic acid
3-Hydroxy-21-oxotirucalla-8,24-dien-26-oic acid is found in beverages. 3-Hydroxy-21-oxotirucalla-8,24-dien-26-oic acid is a constituent of Schinus molle (California peppertree).
Lansic acid
Lansic acid is found in fruits. Lansic acid is a constituent of Lansium domesticum (langsat). Constituent of Lansium domesticum (langsat). Lansic acid is found in fruits.
Murrayenol
Murrayenol is found in herbs and spices. Murrayenol is isolated from roots of Murraya koenigii (curry leaf tree
17,23-Epoxy-29-hydroxy-27-norlanost-8-ene-3,15,24-trione
17,23-Epoxy-29-hydroxy-27-norlanost-8-ene-3,15,24-trione is found in herbs and spices. 17,23-Epoxy-29-hydroxy-27-norlanost-8-ene-3,15,24-trione is from Muscari comosum (tassel hyacinth From Muscari comosum (tassel hyacinth). 17,23-Epoxy-29-hydroxy-27-norlanost-8-ene-3,15,24-trione is found in herbs and spices.
Secoisobryononic acid
Secoisobryononic acid is found in fruits. Secoisobryononic acid is a constituent of Sandoricum koetjape (santol). Constituent of Sandoricum koetjape (santol). Secoisobryononic acid is found in fruits.
3beta-3,24-Dihydroxy-9(11),12-oleanadien-30-oic acid
3beta-3,24-Dihydroxy-9(11),12-oleanadien-30-oic acid is found in herbs and spices. 3beta-3,24-Dihydroxy-9(11),12-oleanadien-30-oic acid is isolated from Glycyrrhiza glabra (licorice). Isolated from Glycyrrhiza glabra (licorice). 3beta-3,24-Dihydroxy-9(11),12-oleanadien-30-oic acid is found in tea and herbs and spices.
Ceanothine C
Ceanothine C is found in tea. Ceanothine C is an alkaloid from the root bark of Ceanothus americanus (New Jersey tea
beta-Glycyrrhetinic acid
beta-Glycyrrhetinic acid is found in herbs and spices. beta-Glycyrrhetinic acid is a constituent of licorice (Glycyrrhiza glabra) root Constituent of licorice (Glycyrrhiza glabra) root. beta-Glycyrrhetinic acid is found in herbs and spices. 18α-Glycyrrhetinic acid, a diet-derived compound, is an inhibitor of NF-kB and an activator of proteasome, which serves as pro-longevity and anti-aggregation factor in a multicellular organism. 18α-Glycyrrhetinic acid induces apoptosis[1][2]. 18α-Glycyrrhetinic acid, a diet-derived compound, is an inhibitor of NF-kB and an activator of proteasome, which serves as pro-longevity and anti-aggregation factor in a multicellular organism. 18α-Glycyrrhetinic acid induces apoptosis[1][2]. 18β-Glycyrrhetinic acid is the major bioactive component of Glycyrrhiza uralensis and possesses anti-ulcerative, anti-inflammatory and antiproliferative properties. 18β-Glycyrrhetinic acid is the major bioactive component of Glycyrrhiza uralensis and possesses anti-ulcerative, anti-inflammatory and antiproliferative properties.
Liquiritic acid
Liquiritic acid is found in herbs and spices. Liquiritic acid is isolated from Glycyrrhiza glabra (licorice Isolated from Glycyrrhiza glabra (licorice). Liquiritic acid is found in tea and herbs and spices.
(3beta,17alpha,23S)-17,23-Epoxy-3,29-dihydroxy-27-norlanosta-7,9(11)-diene-15,24-dione
(3beta,17alpha,23S)-17,23-Epoxy-3,29-dihydroxy-27-norlanosta-7,9(11)-diene-15,24-dione is found in herbs and spices. (3beta,17alpha,23S)-17,23-Epoxy-3,29-dihydroxy-27-norlanosta-7,9(11)-diene-15,24-dione is a constituent of Muscari comosum (tassel hyacinth) Constituent of Muscari comosum (tassel hyacinth). (3beta,17alpha,23S)-17,23-Epoxy-3,29-dihydroxy-27-norlanosta-7,9(11)-diene-15,24-dione is found in herbs and spices.
19alpha-19-Hydroxy-3,11-dioxo-12-ursen-28-oic acid
19alpha-19-Hydroxy-3,11-dioxo-12-ursen-28-oic acid is found in herbs and spices. 19alpha-19-Hydroxy-3,11-dioxo-12-ursen-28-oic acid is a constituent of Sanguisorba officinalis (burnet bloodwort). Constituent of Sanguisorba officinalis (burnet bloodwort). 19alpha-19-Hydroxy-3,11-dioxo-12-ursen-28-oic acid is found in tea and herbs and spices.
2-Hydroxy-3-oxo-12-oleanen-28-oic acid
2-Hydroxy-3-oxo-12-oleanen-28-oic acid is found in herbs and spices. 2-Hydroxy-3-oxo-12-oleanen-28-oic acid is a constituent of Salvia officinalis (sage). Constituent of Salvia officinalis (sage). 2-Hydroxy-3-oxo-12-oleanen-28-oic acid is found in tea and herbs and spices.
16-Hydroxy-3-oxo-12-oleanen-28-oic acid
16-Hydroxy-3-oxo-12-oleanen-28-oic acid is found in alcoholic beverages. 16-Hydroxy-3-oxo-12-oleanen-28-oic acid is isolated from Vitis vinifera (wine grape). Isolated from Vitis vinifera (wine grape). 16-Hydroxy-3-oxo-12-oleanen-28-oic acid is found in alcoholic beverages and fruits.
(9E)-10-Nitrooctadec-9-enoylcarnitine
(9E)-10-nitrooctadec-9-enoylcarnitine is an acylcarnitine. More specifically, it is an (9E)-10-nitrooctadec-9-enoic acid ester of carnitine. Acylcarnitines were first discovered more than 70 year ago (PMID: 13825279). It is believed that there are more than 1000 types of acylcarnitines in the human body. The general role of acylcarnitines is to transport acyl-groups (organic acids and fatty acids) from the cytoplasm into the mitochondria so that they can be broken down to produce energy. This process is known as beta-oxidation. According to a recent review [Dambrova et al. 2021, Physiological Reviews], acylcarnitines (ACs) can be classified into 9 different categories depending on the type and size of their acyl-group: 1) short-chain ACs; 2) medium-chain ACs; 3) long-chain ACs; 4) very long-chain ACs; 5) hydroxy ACs; 6) branched chain ACs; 7) unsaturated ACs; 8) dicarboxylic ACs and 9) miscellaneous ACs. Short-chain ACs have acyl-groups with two to five carbons (C2-C5), medium-chain ACs have acyl-groups with six to thirteen carbons (C6-C13), long-chain ACs have acyl-groups with fourteen to twenty once carbons (C14-C21) and very long-chain ACs have acyl groups with more than 22 carbons. (9E)-10-nitrooctadec-9-enoylcarnitine is therefore classified as a long chain AC. As a long-chain acylcarnitine (9E)-10-nitrooctadec-9-enoylcarnitine is generally formed through esterification with long-chain fatty acids obtained from the diet. The main function of most long-chain acylcarnitines is to ensure long chain fatty acid transport into the mitochondria (PMID: 22804748). Altered levels of long-chain acylcarnitines can serve as useful markers for inherited disorders of long-chain fatty acid metabolism. Carnitine palmitoyltransferase I (CPT I, EC:2.3.1.21) is involved in the synthesis of long-chain acylcarnitines (more than C12) on the mitochondrial outer membrane. Elevated serum/plasma levels of long-chain acylcarnitines are not only markers for incomplete FA oxidation but also are indicators of altered carbohydrate and lipid metabolism. High serum concentrations of long-chain acylcarnitines in the postprandial or fed state are markers of insulin resistance and arise from insulins inability to inhibit CPT-1-dependent fatty acid metabolism in muscles and the heart (PMID: 19073774). Increased intracellular content of long-chain acylcarnitines is thought to serve as a feedback inhibition mechanism of insulin action (PMID: 23258903). In healthy subjects, increased concentrations of insulin effectively inhibits long-chain acylcarnitine production. Several studies have also found increased levels of circulating long-chain acylcarnitines in chronic heart failure patients (PMID: 26796394). The study of acylcarnitines is an active area of research and it is likely that many novel acylcarnitines will be discovered in the coming years. It is also likely that many novel roles in health and disease will be uncovered. An excellent review of the current state of knowledge for acylcarnitines is available at [Dambrova et al. 2021, Physiological Reviews].
(9E)-9-Nitrooctadec-9-enoylcarnitine
(9E)-9-nitrooctadec-9-enoylcarnitine is an acylcarnitine. More specifically, it is an (9E)-9-nitrooctadec-9-enoic acid ester of carnitine. Acylcarnitines were first discovered more than 70 year ago (PMID: 13825279). It is believed that there are more than 1000 types of acylcarnitines in the human body. The general role of acylcarnitines is to transport acyl-groups (organic acids and fatty acids) from the cytoplasm into the mitochondria so that they can be broken down to produce energy. This process is known as beta-oxidation. According to a recent review [Dambrova et al. 2021, Physiological Reviews], acylcarnitines (ACs) can be classified into 9 different categories depending on the type and size of their acyl-group: 1) short-chain ACs; 2) medium-chain ACs; 3) long-chain ACs; 4) very long-chain ACs; 5) hydroxy ACs; 6) branched chain ACs; 7) unsaturated ACs; 8) dicarboxylic ACs and 9) miscellaneous ACs. Short-chain ACs have acyl-groups with two to five carbons (C2-C5), medium-chain ACs have acyl-groups with six to thirteen carbons (C6-C13), long-chain ACs have acyl-groups with fourteen to twenty once carbons (C14-C21) and very long-chain ACs have acyl groups with more than 22 carbons. (9E)-9-nitrooctadec-9-enoylcarnitine is therefore classified as a long chain AC. As a long-chain acylcarnitine (9E)-9-nitrooctadec-9-enoylcarnitine is generally formed through esterification with long-chain fatty acids obtained from the diet. The main function of most long-chain acylcarnitines is to ensure long chain fatty acid transport into the mitochondria (PMID: 22804748). Altered levels of long-chain acylcarnitines can serve as useful markers for inherited disorders of long-chain fatty acid metabolism. Carnitine palmitoyltransferase I (CPT I, EC:2.3.1.21) is involved in the synthesis of long-chain acylcarnitines (more than C12) on the mitochondrial outer membrane. Elevated serum/plasma levels of long-chain acylcarnitines are not only markers for incomplete FA oxidation but also are indicators of altered carbohydrate and lipid metabolism. High serum concentrations of long-chain acylcarnitines in the postprandial or fed state are markers of insulin resistance and arise from insulins inability to inhibit CPT-1-dependent fatty acid metabolism in muscles and the heart (PMID: 19073774). Increased intracellular content of long-chain acylcarnitines is thought to serve as a feedback inhibition mechanism of insulin action (PMID: 23258903). In healthy subjects, increased concentrations of insulin effectively inhibits long-chain acylcarnitine production. Several studies have also found increased levels of circulating long-chain acylcarnitines in chronic heart failure patients (PMID: 26796394). The study of acylcarnitines is an active area of research and it is likely that many novel acylcarnitines will be discovered in the coming years. It is also likely that many novel roles in health and disease will be uncovered. An excellent review of the current state of knowledge for acylcarnitines is available at [Dambrova et al. 2021, Physiological Reviews].
18a-Glycyrrhetinic acid
DG(2:0/PGF2alpha/0:0)
DG(2:0/PGF2alpha/0:0) belongs to the family of Diacylglycerols. These are glycerolipids lipids containing a common glycerol backbone to which at least one fatty acyl group is esterified. DG(2:0/PGF2alpha/0:0) is also a substrate of diacylglycerol kinase. It is involved in the phospholipid metabolic pathway.
DG(PGF2alpha/2:0/0:0)
DG(PGF2alpha/2:0/0:0) belongs to the family of Diacylglycerols. These are glycerolipids lipids containing a common glycerol backbone to which at least one fatty acyl group is esterified. DG(PGF2alpha/2:0/0:0) is also a substrate of diacylglycerol kinase. It is involved in the phospholipid metabolic pathway.
DG(2:0/0:0/PGF2alpha)
DG(2:0/0:0/PGF2alpha) belongs to the family of Diacylglycerols. These are glycerolipids lipids containing a common glycerol backbone to which at least one fatty acyl group is esterified. It is involved in the phospholipid metabolic pathway.
DG(PGF2alpha/0:0/2:0)
DG(PGF2alpha/0:0/2:0) belongs to the family of Diacylglycerols. These are glycerolipids lipids containing a common glycerol backbone to which at least one fatty acyl group is esterified. It is involved in the phospholipid metabolic pathway.
DG(2:0/PGE1/0:0)
DG(2:0/PGE1/0:0) belongs to the family of Diacylglycerols. These are glycerolipids lipids containing a common glycerol backbone to which at least one fatty acyl group is esterified. DG(2:0/PGE1/0:0) is also a substrate of diacylglycerol kinase. It is involved in the phospholipid metabolic pathway.
DG(PGE1/2:0/0:0)
DG(PGE1/2:0/0:0) belongs to the family of Diacylglycerols. These are glycerolipids lipids containing a common glycerol backbone to which at least one fatty acyl group is esterified. DG(PGE1/2:0/0:0) is also a substrate of diacylglycerol kinase. It is involved in the phospholipid metabolic pathway.
DG(2:0/0:0/PGE1)
DG(2:0/0:0/PGE1) belongs to the family of Diacylglycerols. These are glycerolipids lipids containing a common glycerol backbone to which at least one fatty acyl group is esterified. It is involved in the phospholipid metabolic pathway.
DG(PGE1/0:0/2:0)
DG(PGE1/0:0/2:0) belongs to the family of Diacylglycerols. These are glycerolipids lipids containing a common glycerol backbone to which at least one fatty acyl group is esterified. It is involved in the phospholipid metabolic pathway.
DG(2:0/PGD1/0:0)
DG(2:0/PGD1/0:0) belongs to the family of Diacylglycerols. These are glycerolipids lipids containing a common glycerol backbone to which at least one fatty acyl group is esterified. DG(2:0/PGD1/0:0) is also a substrate of diacylglycerol kinase. It is involved in the phospholipid metabolic pathway.
DG(PGD1/2:0/0:0)
DG(PGD1/2:0/0:0) belongs to the family of Diacylglycerols. These are glycerolipids lipids containing a common glycerol backbone to which at least one fatty acyl group is esterified. DG(PGD1/2:0/0:0) is also a substrate of diacylglycerol kinase. It is involved in the phospholipid metabolic pathway.
DG(2:0/0:0/PGD1)
DG(2:0/0:0/PGD1) belongs to the family of Diacylglycerols. These are glycerolipids lipids containing a common glycerol backbone to which at least one fatty acyl group is esterified. It is involved in the phospholipid metabolic pathway.
DG(PGD1/0:0/2:0)
DG(PGD1/0:0/2:0) belongs to the family of Diacylglycerols. These are glycerolipids lipids containing a common glycerol backbone to which at least one fatty acyl group is esterified. It is involved in the phospholipid metabolic pathway.
Kuguacin A
Kuguacin a is practically insoluble (in water) and an extremely weak acidic compound (based on its pKa). Kuguacin a can be found in bitter gourd, which makes kuguacin a a potential biomarker for the consumption of this food product.
A-Homo-3a-oxa-5beta-olean-12-en-3-one-28-oic acid
16a-Hydroxydehydrotrametenolic acid
16alpha-Hydroxydehydrotrametenolic acid is a natural product found in Wolfiporia cocos with data available.
Zhankuic acid B
A steroid acid that is ergosta-8,24(28)-dien-26-oic acid substituted by a hydroxy group at position 3, a methyl group at position 4 and oxo groups at positions 7 and 11 (the 3alpha,4alpha,5alpha stereoisomer). Isolated from Antrodia cinnamomea and Antrodia camphorata, it exhibits cytotoxic, anticholinergic and antiserotonergic activities.
(24Z)-3-Oxo-12alpha-hydroxylanosta-8,24-dien-26-oic acid
Karavilagenin D
2H-Pyran-2-one,3-[[(1R,4aR,5S,6S,8aR)-6-(acetyloxy)decahydro-5,8a-dimethyl-2-methylene-5-(4-methyl-3-penten-1-yl)-1-naphthalenyl]methyl]-4-hydroxy-5,6-dimethyl-,rel-(-)-
2,2,4,4,10,13a-Hexamethyl-6,7-isopropylidene-10,11-epoxy-14-isobutyl-1,2,3,4,5a,6,7,8,9,10,11,12,13,13a,14-pentadecahydro-5-oxacyclodeca[b]naphthalene-1,3-dione
Hyperinol B
A hexacyclic triterpenoid that is 13,28-epoxyursan-28-one with a terminal double bond between positions 20(30) and is substituted by hydroxy groups at position 3 and 22 (the 3beta,19alpha,22alpha stereoisomer). It is a taraxastane-type triterpene isolated from Hypericum oblongifolium and exhibits enzyme inhibitory activity against chymotrypsin.
Ganoderone C
A tetracyclic triterpenoid that is 5alpha-lanosta-8-ene with an epoxy group across positions 24 and 25, a hydroxy group at position 26 and oxo groups at positions 3 and 7. Isolated from the fruiting bodies of Ganoderma pfeifferi, it exhibits antiviral activity against influenza A virus.
Kuguacin N
Kuguacin N is a natural product found in Momordica charantia with data available.
Virgatic acid
A pentacyclic triterpenoid that is olean-12-ene substituted by a carboxy group at position 28, a beta-hydroxy group at position 3 and an oxo group at position 1. It has been isolated from Juglans sinensis.
(E,6S)-7-hydroxy-2-methyl-6-[(10S,13S,14S,17S)-4,4,10,13,14-pentamethyl-3-oxo-1,2,5,6,7,11,12,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]hept-2-enoic acid
2alpha,3beta-dihydroxy-13alpha,27-cyclours-11-en-28-oic acid|euscaphic acid E
4,4,8-Trimethyl-3??,7??,23-trihydroxy-chola-14,24-dien-21-oic acid-21,23-lactone
(3beta,11alpha,12alpha,13beta)-11,12-Epoxy-3-hydroxy-28,13-ursanolide|(3beta,11alpha,12alpha,13beta)-11,12-Epoxy-3-hydroxypregn-28,13-ursanolide|3beta,13-dihydroxy-11alpha,12alpha-epoxyursan-28-oic acid gamma-lactone|3beta-hydroxy-11alpha,12alpha-epoxyurs-13beta,28-olide
Ulmoidol
Ulmoidol is a natural product found in Ilex kaushue and Eucommia ulmoides with data available.
25-Hydroxy-3-oxo-12-oleanen-30-oic acid|3-oxo-25-hydroxy-olean-12-en-30-oic acid
2,3-(2,2-dimethyl-3,4-dihydro-2H-pyran)-6-(1-oxopropyl)-4,8-diprenyl-8beta-H-cis-bicyclo[3.3.1]non-1,5-dione|garcinielliptone B
3,4;19,21-di-seco-lupa-4(23),20(29)-diene-21,19-lacton-3-oic acid|lippiolidolic acid
(E)-4-(3,4-dimethoxyphenyl)-but-3-en-1-yl linoleate
ent-14-labden-8beta,19-diol 13alpha-O-alpha-L-rhamnopyranoside
(23R,24E)-3-oxo-9beta-lanosta-7,24-dien-23-hydroxy-26-oic acid|abiesatrine G
3alpha-hydroxy-11alpha,12alpha-epoxyoleanane-28,13beta-olide
(3R,14R,17R,28R)-1,12,18,29-triacontatetrayne-3,14,17,28-tetrol|(all-R)-form-1,12,18,29-Triacontatetrayne-3,14,17,28-tetrol
(2alpha,3alpha,19alpha)-2,3,19-trihydroxyurs-13(18)-en-28-oic acid gamma-lactone|serrulatin C
2-ethoxycarbonyl-2beta-hydroxy-A-nor-ergosta-5,24(28)-dien-4-one
2-((2E,6E,10E)-5-acetoxy-12-hydroxy-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraenyl)-6-methylhydroquinol|2-<(2E,6E,10E)-5-acetoxy-12-hydroxy-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraenyl>-6-methylhydroquinol
4-Phenylphenacyl ester-(E)-11,17-Octadecadien-9-ynoic acid
3beta-hydroxy-1,11-dioxo-ergosta-8,24(28)-diene-4alpha-carboxylic acid
Ac-(3beta,5alpha,25R)-3-Hydroxyspirost-9(11)-en-12-one
1-methyl-L-proline (4S)-7t-sec-(or iso)butyl-3t-isopropyl-5,8-dioxo-2-oxa-6,9-diaza-1(1,4)-benzena-cycloundecaphan-10c-en-4r-ylamide|Ceanothin C|ceanothine-C
(5S,10S,13R,17R,20S,21R,22R,23S,24R)-21,23;22,28-diepoxy-21,24-dihydroxystigmasta-8,14-dien-3-one|vernoanthelcin I
(R)-methyl 2-{3-[(E)-3,7-dimethylocta-2,6-dien-1-yl]-2,5-dihydroxyphenyl}-2-[(1S,2S,5S)-2-hydroxy-5-isopropyl-2-methylcyclohex-3-en-1-yl]acetate|melissifoliane A
(E)-methyl 2-{3-[(E)-3,7-dimethylocta-2,6-dien-1-yl]-2,5-dihydroxyphenyl}-4-hydroxy-5,9-dimethyldeca-5,8-dienoate|melissifoliane B
3beta,23-dihydroxy-1-oxo-30-norolean-12,20(29)-dien-28-oic acid|euscaphic acid G
ent-14-labden-8beta-ol 13alpha-O-beta-D-glucopyranoside
24-hydroxy-A(1)-nor-2,20(29)-lupadien-27,28-dioic acid|gouanic acid B
Correllogenin-acetat|Correlogenin-acetat|Correlogenin-acetat; Neobotogenin-acetat|O-Acetyl-neobotogenin
1-methyl-L-proline (4S)-3xi-ethyl-7t-isobutyl-3xi-methyl-5,8-dioxo-2-oxa-6,9-diaza-1(1,4)-benzena-cycloundecaphan-10c-en-4r-ylamide|Ceanothin-D|ceanothine-D
(25S)-18-acetoxy-3-oxocholesta-1,4-dien-26-oic acid
2-((2E,6E)-5-acetoxy-3,7,11,15-tetramethyl-12-oxohexadeca-2,6,14-trienyl)-6-methylhydroquinol|2-<(2E,6E)-5-acetoxy-3,7,11,15-tetramethyl-12-oxohexadeca-2,6,14-trienyl>-6-methylhydroquinol
8alpha,15,16-trihydroxy-labd-13E-ene-8-O-fucopyranoside
(24R)-27-nor-5alpha-cholestane-3beta,4beta,6alpha,8,14,15alpha,24-heptaol
2,15alpha,22beta-trihydroxy-3-methoxy-24,29-dinor-1,3,5(10)-friedelatriene-21-one
11alpha,12alpha-EPOXY-3beta,23-DIHYDROXY-30-NOROLEAN-20(29)-EN-28,13beta-OLIDE
Siraitic Acid B
BW45NB63RE
11alpha,12alpha-epoxy-3beta,23-dihydroxy-30-nor-olean-20(29)-en-28,13beta-olide is a gamma-lactone. It has a role as a metabolite. 11alpha,12alpha-Epoxy-3beta,23-dihydroxy-30-norolean-20(29)-en-28,13beta-olide is a natural product found in Paeonia lactiflora and Paeonia rockii with data available. See also: Paeonia lactiflora root (part of). A natural product found in Paeonia rockii subspeciesrockii.
3-Hydroxyspirost-9(11)-en-12-one, 3-Ac
Origin: Plant; SubCategory_DNP: The sterols, Cholestanes
Ala Lys Pro Arg
Ala Lys Arg Pro
Ala Pro Lys Arg
Ala Pro Arg Lys
Ala Arg Lys Pro
Ala Arg Pro Lys
Glu Ile Ile Pro
Glu Ile Leu Pro
Glu Ile Pro Ile
Glu Ile Pro Leu
Glu Leu Ile Pro
Glu Leu Leu Pro
Glu Leu Pro Ile
Glu Leu Pro Leu
Glu Pro Ile Ile
Glu Pro Ile Leu
Glu Pro Leu Ile
Glu Pro Leu Leu
Ile Glu Ile Pro
Ile Glu Leu Pro
Ile Glu Pro Ile
Ile Glu Pro Leu
Ile Ile Glu Pro
Ile Ile Pro Glu
Ile Lys Asn Pro
Ile Lys Pro Asn
Ile Leu Glu Pro
Ile Leu Pro Glu
Ile Asn Lys Pro
Ile Asn Pro Lys
Ile Pro Glu Ile
Ile Pro Glu Leu
Ile Pro Ile Glu
Ile Pro Lys Asn
Ile Pro Leu Glu
Ile Pro Asn Lys
Lys Ala Pro Arg
Lys Ala Arg Pro
Lys Ile Asn Pro
Lys Ile Pro Asn
Lys Lys Pro Val
Lys Lys Val Pro
Lys Leu Asn Pro
Lys Leu Pro Asn
Lys Asn Ile Pro
Lys Asn Leu Pro
Lys Asn Pro Ile
Lys Asn Pro Leu
Lys Pro Ala Arg
Lys Pro Ile Asn
Lys Pro Lys Val
Lys Pro Leu Asn
Lys Pro Asn Ile
Lys Pro Asn Leu
Lys Pro Gln Val
Lys Pro Arg Ala
Lys Pro Val Lys
Lys Pro Val Gln
Lys Gln Pro Val
Lys Gln Val Pro
Lys Arg Ala Pro
Lys Arg Pro Ala
Lys Val Lys Pro
Lys Val Pro Lys
Lys Val Pro Gln
Lys Val Gln Pro
Leu Glu Ile Pro
Leu Glu Leu Pro
Leu Glu Pro Ile
Leu Glu Pro Leu
Leu Ile Glu Pro
Leu Ile Pro Glu
Leu Lys Asn Pro
Leu Lys Pro Asn
Leu Leu Glu Pro
Leu Leu Pro Glu
Leu Asn Lys Pro
Leu Asn Pro Lys
Leu Pro Glu Ile
Leu Pro Glu Leu
Leu Pro Ile Glu
Leu Pro Lys Asn
Leu Pro Leu Glu
Leu Pro Asn Lys
Asn Ile Lys Pro
Asn Ile Pro Lys
Asn Lys Ile Pro
Asn Lys Leu Pro
Asn Lys Pro Ile
Asn Lys Pro Leu
Asn Leu Lys Pro
Asn Leu Pro Lys
Asn Pro Ile Lys
Asn Pro Lys Ile
Asn Pro Lys Leu
Asn Pro Leu Lys
Pro Ala Lys Arg
Pro Ala Arg Lys
Pro Glu Ile Ile
Pro Glu Ile Leu
Pro Glu Leu Ile
Pro Glu Leu Leu
Pro Ile Glu Ile
Pro Ile Glu Leu
Pro Ile Ile Glu
Pro Ile Lys Asn
Pro Ile Leu Glu
Pro Ile Asn Lys
Pro Lys Ala Arg
Pro Lys Ile Asn
Pro Lys Lys Val
Pro Lys Leu Asn
Pro Lys Asn Ile
Pro Lys Asn Leu
Pro Lys Gln Val
Pro Lys Arg Ala
Pro Lys Val Lys
Pro Lys Val Gln
Pro Leu Glu Ile
Pro Leu Glu Leu
Pro Leu Ile Glu
Pro Leu Lys Asn
Pro Leu Leu Glu
Pro Leu Asn Lys
Pro Asn Ile Lys
Pro Asn Lys Ile
Pro Asn Lys Leu
Pro Asn Leu Lys
Pro Gln Lys Val
Pro Gln Val Lys
Pro Arg Ala Lys
Pro Arg Lys Ala
Pro Val Lys Lys
Pro Val Lys Gln
Pro Val Gln Lys
Gln Lys Pro Val
Gln Lys Val Pro
Gln Pro Lys Val
Gln Pro Val Lys
Gln Val Lys Pro
Gln Val Pro Lys
Arg Ala Lys Pro
Arg Ala Pro Lys
Arg Lys Ala Pro
Arg Lys Pro Ala
Arg Pro Ala Lys
Arg Pro Lys Ala
Val Lys Lys Pro
Val Lys Pro Lys
Val Lys Pro Gln
Val Lys Gln Pro
Val Pro Lys Lys
Val Pro Lys Gln
Val Pro Gln Lys
Val Gln Lys Pro
Val Gln Pro Lys
(5Z,7E)-(1S,3R,25R)-26,26,26-trifluoro-9,10-seco-5,7,10(19)-cholestatriene-1,3,25-triol
(5Z,7E)-(1S,3R,25S)-26,26,26-trifluoro-9,10-seco-5,7,10(19)-cholestatriene-1,3,25-triol
17,23-Epoxy-29-hydroxy-27-norlanost-8-ene-3,15,24-trione
(3beta,17alpha,23S)-17,23-Epoxy-3,29-dihydroxy-27-norlanosta-7,9(11)-diene-15,24-dione
(25R)-26,26,26-trifluoro-1alpha,25-dihydroxyvitamin D3
(25S)-26,26,26-trifluoro-1alpha,25-dihydroxyvitamin D3
CIS-1,2-DIBORONO-1,2-DIPHENYLETHYLENE, DIPINACOL ESTER
butyl prop-2-enoate,ethenyl acetate,2-ethylhexyl prop-2-enoate,prop-2-enoic acid
2-[3-[1-(5-Carboxypentyl)-1,3-dihydro-3,3-dimethyl-2H-indol-2-ylidene]-1-propenyl]-1-ethyl-3,3-dimethyl-3H-indolium inner salt
TERT-BUTYL 3,5-BIS(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-1H-PYRROLO[2,3-B]PYRIDINE-1-CARBOXYLATE
Phenol,4,4-[thiobis(methylene)]bis[2,6-bis(1,1-dimethylethyl)-
Methanone, ((3S,4R)-4-(2,4-difluorophenyl)-1-(1,1-dimethylethyl)-3-pyrrolidinyl)((3R,5S)-4-hydroxy-3,5-dimethyl-4-phenyl-1-piperidinyl)-
(4alpha,5alpha,7beta,25S)-7-Hydroxy-4-methyl-3,11-dioxoergosta-8,24(28)-dien-26-oic acid
(25R)-26,26,26-trifluoro-1alpha,25-dihydroxyvitamin D3/(25R)-26,26,26-trifluoro-1alpha,25-dihydroxycholecalciferol
Methymycin(1+)
An organic cation that is the conjugate acid of methymycin, obtained by protonation of the tertiary amino group; major species at pH 7.3.
Neomethymycin(1+)
An organic cation that is the conjugate acid of neomethymycin, obtained by protonation of the tertiary amino group; major species at pH 7.3.
19alpha-19-Hydroxy-3,11-dioxo-12-ursen-28-oic acid
Minabeolide 8
A withanolide that is (22R,25S)-22,26-epoxycholest-4-en-26-one substituted by an oxo group at position 3 and an alpha-acetoxy group at position 11. Isolated from Paraminabea acronocephala, it exhibits anti-inflammatory activity.
4-[4-[[[1-(2-methylpropyl)-3-pyrrolidinyl]methylamino]-oxomethyl]-3-oxo-1H-isoindol-2-yl]-1-piperidinecarboxylic acid ethyl ester
(2R,3S,4S,4aR,5aS,6aR,8R,9S,11S,12aS,13aR,14S,15S,15aS)-9-(hydroxymethyl)-3,4,11,14-tetramethyloctadecahydro-3H-spiro[furan-2,2-pyrano[2,3:6,7]oxepino[2,3:5,6]pyrano[3,2-b]oxocine]-8,15-diol
2,3-Dihydroxypropyl (3-hexadecoxy-2-hydroxypropyl) hydrogen phosphate
2-[2-[3-(1-Methylethylamino)-2-hydroxypropyloxy]ethyl]-2,5,7,8-tetramethyl-3,4-dihydro-2H-1-benzopyran-6-carboxylic acid 3-pyridyl ester
[2-[(4E,7E)-deca-4,7-dienoyl]oxy-3-hydroxypropyl] (5E,7E,9E,11E,13E)-hexadeca-5,7,9,11,13-pentaenoate
n-[3-ethyl-5,8-dihydroxy-3-methyl-7-(2-methylpropyl)-2-oxa-6,9-diazabicyclo[10.2.2]hexadeca-1(14),5,8,10,12,15-hexaen-4-yl]-1-methylpyrrolidine-2-carboximidic acid
(1s,3as,3bs,9ar,9bs,11as)-1-hydroxy-1-[(1r)-1-[(1r,2r,4r,6s)-2-methoxy-1,6-dimethyl-3,7-dioxabicyclo[4.1.0]heptan-4-yl]ethyl]-9a,11a-dimethyl-2h,3h,3ah,3bh,4h,6h,9bh,10h,11h-cyclopenta[a]phenanthren-9-one
n-methyl-5-(n-methylformamido)-3-[(2e,6e,11z)-3,7,11,15-tetramethyl-13-oxohexadeca-2,6,11-trien-1-yl]imidazole-4-carboximidic acid
2-({5-[2-hydroxy-5-(hydroxymethyl)-2,5,8a-trimethyl-hexahydro-1h-naphthalen-1-yl]-3-methylpent-1-en-3-yl}oxy)-6-methyloxane-3,4,5-triol
(1s,2r,5r,6s,9r,10r,13r,14r,15r,18s)-6-(hydroxymethyl)-2,6,9-trimethyl-15-(prop-1-en-2-yl)pentacyclo[11.7.0.0²,¹⁰.0⁵,⁹.0¹⁴,¹⁸]icos-7-ene-1,18-dicarboxylic acid
3,9-dihydroxy-10,12,14,16,20,21,22-heptamethyl-23,24-dioxatetracyclo[17.3.1.1⁶,⁹.0²,⁷]tetracosa-2,5,7,14-tetraen-4-one
6-(hydroxymethyl)-2,6,9-trimethyl-15-(prop-1-en-2-yl)pentacyclo[11.7.0.0²,¹⁰.0⁵,⁹.0¹⁴,¹⁸]icos-7-ene-1,18-dicarboxylic acid
(1s,2s,4ar,5r,8ar)-5-[(4-hydroxy-5,6-dimethyl-2-oxopyran-3-yl)methyl]-1,4a-dimethyl-6-methylidene-1-(4-methylpent-3-en-1-yl)-hexahydro-2h-naphthalen-2-yl acetate
(2s,3r,4s,5s,6r)-2-{[(3s)-5-[(1s,2r,4ar,8ar)-2-hydroxy-2,5,5,8a-tetramethyl-hexahydro-1h-naphthalen-1-yl]-3-methylpent-1-en-3-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol
3-[(1s,4ar,5s,6r,8ar)-5-{[5-(acetyloxy)-2-hydroxy-3-methylphenyl]methyl}-5,6,8a-trimethyl-2-(propan-2-ylidene)-hexahydro-1h-naphthalen-1-yl]propanoic acid
(2r,6r)-6-[(1r,3ar,4r,5as,6s,9as,11ar)-4-hydroxy-6,9a,11a-trimethyl-7,10-dioxo-1h,2h,3h,3ah,4h,5h,5ah,6h,8h,9h,11h-cyclopenta[a]phenanthren-1-yl]-2-methyl-3-methylideneheptanoic acid
2-{[4-(5-hydroxy-3-methylpent-3-en-1-yl)-3,8-bis(hydroxymethyl)-4a,8-dimethyl-1,2,5,6,7,8a-hexahydronaphthalen-1-yl]oxy}oxane-3,4,5-triol
n-methyl-5-(n-methylformamido)-3-(3,7,11,15-tetramethyl-13-oxohexadeca-2,6,11-trien-1-yl)imidazole-4-carboximidic acid
(2s,6r)-6-[(1s,3ar,5as,6s,9as,11ar)-4-hydroxy-6,9a,11a-trimethyl-7,10-dioxo-1h,2h,3h,3ah,4h,5h,5ah,6h,8h,9h,11h-cyclopenta[a]phenanthren-1-yl]-2-methyl-3-methylideneheptanoic acid
3-[(1s,4ar,5s,6s,8ar)-5-{[5-(acetyloxy)-2-hydroxy-3-methylphenyl]methyl}-5,6,8a-trimethyl-2-(propan-2-ylidene)-hexahydro-1h-naphthalen-1-yl]propanoic acid
11α,12α-epoxy-3β,23-dihydroxy-30-norolean-20-en-28,13β-olide
{"Ingredient_id": "HBIN000338","Ingredient_name": "11\u03b1,12\u03b1-epoxy-3\u03b2,23-dihydroxy-30-norolean-20-en-28,13\u03b2-olide","Alias": "NA","Ingredient_formula": "C29H42O5","Ingredient_Smile": "CC12CCC(C(C1CCC3(C2C4C(O4)C56C3(CCC7(C5CC(=C)CC7)C(=O)O6)C)C)(C)CO)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "41440","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
11α, 12α-epoxy--3β, 23dihy-droxyolean-28, 13β-olide
{"Ingredient_id": "HBIN000339","Ingredient_name": "11\u03b1, 12\u03b1-epoxy--3\u03b2, 23dihy-droxyolean-28, 13\u03b2-olide","Alias": "11\u03b1,12\u03b1-epoxy-3\u03b2,23-dihydroxyolean-28,13\u03b2-olide","Ingredient_formula": "C29H42O5","Ingredient_Smile": "CC12CCC(C(C1CCC3(C2C4C(O4)C56C3(CCC7(C5CC(=C)CC7)C(=O)O6)C)C)(C)CO)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "41465;41441","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
