Exact Mass: 244.18270539999997
Exact Mass Matches: 244.18270539999997
Found 500 metabolites which its exact mass value is equals to given mass value 244.18270539999997,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Anagyrine
Anagyrine is an alkaloid. Anagyrine is a natural product found in Daphniphyllum oldhamii, Ormosia fordiana, and other organisms with data available. Thermospine is a natural product found in Platycelyphium voense, Thermopsis mongolica, and other organisms with data available. Thermopsine is a quinolizidine alkaloid isolated from the fruits and pods and stem bark of Sophora velutina subsp. Thermopsine has antibacterial activity[1].
Panaxynol
Panaxynol is a long-chain fatty alcohol. It has a role as a metabolite. Falcarinol is a natural product found in Chaerophyllum aureum, Cussonia arborea, and other organisms with data available.
Sophoramine
Sophoramine is a naphthyridine derivative. Sophoramine is a natural product found in Sophora viciifolia, Sophora pachycarpa, and other organisms with data available.
Xylometazoline
A nasal vasoconstricting decongestant drug which acts by binding to the same receptors as adrenaline. It is applied as a spray or as drops into the nose to ease inflammation and congestion of the nasal passageways. It binds alpha-adrenergic receptors to activate the adrenal system which causes systemic vasoconstriction, thereby easing nasal congestion. R - Respiratory system > R01 - Nasal preparations > R01A - Decongestants and other nasal preparations for topical use > R01AB - Sympathomimetics, combinations excl. corticosteroids R - Respiratory system > R01 - Nasal preparations > R01A - Decongestants and other nasal preparations for topical use > R01AA - Sympathomimetics, plain S - Sensory organs > S01 - Ophthalmologicals > S01G - Decongestants and antiallergics > S01GA - Sympathomimetics used as decongestants C78272 - Agent Affecting Nervous System > C29747 - Adrenergic Agent > C87053 - Adrenergic Agonist C308 - Immunotherapeutic Agent > C29578 - Histamine-1 Receptor Antagonist D019141 - Respiratory System Agents > D014663 - Nasal Decongestants D002317 - Cardiovascular Agents > D014662 - Vasoconstrictor Agents CONFIDENCE standard compound; EAWAG_UCHEM_ID 3031
2-Hydroxymyristic acid
2-Hydroxymyristic acid is an analog of myristic acid that becomes metabolically activated in cells to form 2-hydroxymyristoyl-CoA, a potent inhibitor of myristoyl-CoA:protein N-myristoyltransferase, the enzyme that catalyzes protein N-myristoylation. Treatment of T cells with 2-hydroxymyristic acid inhibits the myristoylation and alters the stability of p56lck. (PMID 8103677) [HMDB] 2-Hydroxymyristic acid is an analog of myristic acid that becomes metabolically activated in cells to form 2-hydroxymyristoyl-CoA, a potent inhibitor of myristoyl-CoA:protein N-myristoyltransferase, the enzyme that catalyzes protein N-myristoylation. Treatment of T cells with 2-hydroxymyristic acid inhibits the myristoylation and alters the stability of p56lck. (PMID 8103677).
Leucyl-leucine
Leucylleucine is a dipeptide composed of two leucine residues. It is an incomplete breakdown product of protein digestion or protein catabolism. Some dipeptides are known to have physiological or cell-signalling effects although most are simply short-lived intermediates on their way to specific amino acid degradation pathways following further proteolysis. Leu-Leu-OH, a Leu derivative, is a dipeptide.
6-(6-aminohexanamido)hexanoic acid
C12H24N2O3 (244.17868339999998)
Rhombifoline
Rhombifoline is a natural product found in Plagiocarpus axillaris, Cristonia biloba, and other organisms with data available. Rhombifoline is an alkaloid isolated for the first time from the leaves and stems of A. foetida L.[1]. Rhombifoline is an alkaloid isolated for the first time from the leaves and stems of A. foetida L.[1].
Panaxynol
Panaxynol is found in carrot. Panaxynol is isolated from ginsen Carrotatoxin, also known as falcarinol, (Z)-isomer or panaxynol, is a member of the class of compounds known as long-chain fatty alcohols. Long-chain fatty alcohols are fatty alcohols that have an aliphatic tail of 13 to 21 carbon atoms. Carrotatoxin is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Carrotatoxin can be found in carrot and wild carrot, which makes carrotatoxin a potential biomarker for the consumption of these food products.
UNII:FL8S7F2JJQ
A 3-hydroxytetradecanoic acid that has R configuration at position 3. It plays an intermediate role in fatty acid biosynthesis.
Thermopsine
relative retention time with respect to 9-anthracene Carboxylic Acid is 0.155 relative retention time with respect to 9-anthracene Carboxylic Acid is 0.144 Thermopsine is a quinolizidine alkaloid isolated from the fruits and pods and stem bark of Sophora velutina subsp. Thermopsine has antibacterial activity[1].
(R)-3-Hydroxy-tetradecanoic acid
In humans fatty acids are predominantly formed in the liver and adipose tissue, and mammary glands during lactation. (R)-3-Hydroxy-tetradecanoic acid is an intermediate in fatty acid biosynthesis. Specifically, (R)-3-Hydroxy-tetradecanoic acid is converted from 3-Oxo-tetradecanoic acid via fatty-acid Synthase and 3-oxoacyl- [acyl-carrier-protein] reductase. (EC: 2.3.1.85 and EC:2.3.1.41) [HMDB] In humans fatty acids are predominantly formed in the liver and adipose tissue, and mammary glands during lactation. (R)-3-Hydroxy-tetradecanoic acid is an intermediate in fatty acid biosynthesis. Specifically, (R)-3-Hydroxy-tetradecanoic acid is converted from 3-Oxo-tetradecanoic acid via fatty-acid Synthase and 3-oxoacyl- [acyl-carrier-protein] reductase. (EC: 2.3.1.85 and EC:2.3.1.41).
4-Acetyl-6-tert-butyl-1,1-dimethylindane
4-Acetyl-6-tert-butyl-1,1-dimethylindane is a flavouring ingredien Flavouring ingredient D003358 - Cosmetics
Isoleucyl-Isoleucine
C12H24N2O3 (244.17868339999998)
Isoleucyl-Isoleucine is a dipeptied compoosed of two isoleucine residues. It is an incomplete breakdown product of protein digestion or protein catabolism. Some dipeptides are known to have physiological or cell-signaling effects although most are simply short-lived intermediates on their way to specific amino acid degradation pathways following further proteolysis. This dipeptide has not yet been identified in human tissues or biofluids and so it is classified as an Expected metabolite.
Leucyl-Isoleucine
C12H24N2O3 (244.17868339999998)
Leucyl-Isoleucine is a dipeptide composed of leucine and isoleucine. It is an incomplete breakdown product of protein digestion or protein catabolism. Some dipeptides are known to have physiological or cell-signaling effects although most are simply short-lived intermediates on their way to specific amino acid degradation pathways following further proteolysis. This dipeptide has not yet been identified in human tissues or biofluids and so it is classified as an Expected metabolite.
1,11-Undecanedicarboxylic acid
1,11-Undecanedicarboxylic acid, also known as 1,13-tridecanedioic acid or brassilic acid, belongs to the class of organic compounds known as long-chain fatty acids. These are fatty acids with an aliphatic tail that contains between 13 and 21 carbon atoms. 1,11-Undecanedicarboxylic acid is a very hydrophobic molecule, practically insoluble in water, and relatively neutral. Undecanedicarboxylic acid is an unusual odd-numbered dicarboxylic acid that appears in the urines of children with neonatal adrenoleukodystrophy and Zellweger syndrome, as an additional marker of these peroxisomal disorders. (PMID: 2943344) [HMDB] Tridecanedioic acid is an endogenous metabolite.
Hydroxyprolyl-Leucine
Hydroxyprolyl-Leucine is a dipeptide composed of hydroxyproline and leucine. It is an incomplete breakdown product of protein digestion or protein catabolism. Some dipeptides are known to have physiological or cell-signaling effects although most are simply short-lived intermediates on their way to specific amino acid degradation pathways following further proteolysis. This dipeptide has not yet been identified in human tissues or biofluids and so it is classified as an Expected metabolite.
Hydroxyprolyl-Isoleucine
Hydroxyprolyl-Isoleucine is a dipeptide composed of hydroxyproline and isoleucine. It is an incomplete breakdown product of protein digestion or protein catabolism. Some dipeptides are known to have physiological or cell-signaling effects although most are simply short-lived intermediates on their way to specific amino acid degradation pathways following further proteolysis. This dipeptide has not yet been identified in human tissues or biofluids and so it is classified as an Expected metabolite.
Isoleucylhydroxyproline
Isoleucylhydroxyproline is a dipeptide composed of isoleucine and hydroxyproline. It is an incomplete breakdown product of protein digestion or protein catabolism. Some dipeptides are known to have physiological or cell-signaling effects although most are simply short-lived intermediates on their way to specific amino acid degradation pathways following further proteolysis.
Isoleucyl-Leucine
C12H24N2O3 (244.17868339999998)
Isoleucyl-Leucine is a dipeptide composed of isoleucine and leucine. It is an incomplete breakdown product of protein digestion or protein catabolism. Some dipeptides are known to have physiological or cell-signaling effects although most are simply short-lived intermediates on their way to specific amino acid degradation pathways following further proteolysis. This dipeptide has not yet been identified in human tissues or biofluids and so it is classified as an Expected metabolite.
Leucylhydroxyproline
Leucylhydroxyproline is a dipeptide composed of leucine and hydroxyproline. It is an incomplete breakdown product of protein digestion or protein catabolism. Some dipeptides are known to have physiological or cell-signaling effects although most are simply short-lived intermediates on their way to specific amino acid degradation pathways following further proteolysis.
3-(L-Menthoxy)-2-methylpropane-1,2-diol
3-(L-Menthoxy)-2-methylpropane-1,2-diol is used as a food additive [EAFUS] ("EAFUS: Everything Added to Food in the United States. [http://www.eafus.com/]") It is used as a food additive .
Menthyl ethylene glycol carbonate
Menthyl ethylene glycol carbonate is a physiological cooling agent used in foods. Strong mint flavorant used in chewing gu Physiol. cooling agent used in foods. Strong mint flavorant used in chewing gum
(±)-1,4-Nonanediol diacetate
(±)-1,4-Nonanediol diacetate is a flavouring ingredient. Flavouring ingredient
Ethyl 3-hydroxydodecanoate
Ethyl 3-hydroxydodecanoate belongs to the family of Fatty Alcohols. These are aliphatic alcohols consisting of a chain of 8 to 22 carbon atoms.
3-hydroxymyristate
3-Hydroxytetradecanoic acid (CAS: 1961-72-4) is a long-chain hydroxy fatty acid. In humans fatty acids are predominantly formed in the liver and adipose tissue, and mammary glands during lactation. (R)-3-Hydroxytetradecanoic acid is the most common fatty acid constituent of the lipid A component of bacterial lipopolysaccharides (LPS). 3-Hydroxytetradecanoic acid can be found in feces
(1R,9S,10S)-7,15-Diazatetracyclo[7.7.1.02,7.010,15]heptadeca-2,4-dien-6-one
(2R,4S)-1-Tert-Butyl 2-methyl 4-aminopyrrolidine-1,2-dicarboxylate
4-(4-Aminophenyl)-2,2,6,6-tetramethylcyclohex-3-en-1-amine
(2S)-6-Amino-2-(hexanoylamino)hexanoic Acid
C12H24N2O3 (244.17868339999998)
Leucyl-leucine
C12H24N2O3 (244.17868339999998)
Butanoyl (2S)-2-amino-5-(diaminomethylideneamino)pentanoate
(8R,9R,10S,13S,14S)-13-Methyl-1,4,5,6,7,8,9,10,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthrene
Linderoxide
Methyl 3,4-dihydro-5-methyl-8-isopropyl-2-naphthalenecarboxylate
Isolinderoxide
3-HYDROXYMYRISTIC ACID
A 3-hydroxy fatty acid that is tetradecanoic (myristic) acid substituted at position 3 by a hydroxy group
(all-E)-8,10,16-Heptadecatrien-6-yn-3-one|heptadeca-8t,10t,16-trien-6-yn-3-one|Heptadecatrien-(1.7-trans.9-trans)-in-(11)-on-(15)
2,4-Diamino-2,3,4,6-tetradeoxy-arabino-hexose,9CI,8CI-Me glycoside, 2,4-di-N-Ac
14-acetoxy-tetradeca-2t,4t,8t,10t-tetraen-6-yne|Ac-4,6,10,12-Tetradecatetraen-8-yn-2-ol,|Tetradecatetra-4,6,10,12-en-8-in-1-ol-acetat
(E)-form-2-(1-Tridecen-12-ynyl)furan|13-(2-furyl)-tridec-12E-en-1-yne|avocadynenofuran
Megastigm-7-ene-3,5,6,9-tetraol
Megastigm-7-ene-3,5,6,9-tetraol is a natural product found in Cestrum parqui with data available.
(+)-(5S,10S)-13-hydroxypodocarpa-8,11,13-triene|(+)-13-hydroxypodocarpa-8,11,13-triene|13-hydroxy-13-deisopropyldehydroabietane|13-hydroxy-8,11,13-podocarpatriene|podocarpa-8,11,13-trien-13-ol|trans-7-Hydroxy-1,1,12-trimethyl-1,2,3,4,9,10,11,12-octahydro-phenanthren
(all-E)-1,7,9,13-Heptadecatetraen-11-yn-3-ol|heptadeca-1,7t,9t,13t-tetraen-11-yn-3-ol|Heptadecatetraen-(1.7trans.9trans.13trans)-in-(11)-ol-(3)
Me ether-(2R*,5S*,1E,3E)-form-Tetrahydro-5-(1,3-undecadiene-5,7-diynyl)-2-furanol,
6alpha-Furanoeremophilan-15, 6-olide|Furanoermophilan-14, 6-olide
14-hydroxymyristic acid
A long-chain fatty acid that is myristic (tetradecanoic) acid substituted at position 14 by a hydroxy group.
(E)-1,9-Heptadecadiene-11,13-diyn-8-ol|9-trans-Heptadecadien-(1.9)-diin-(11.13)-ol-(8)|heptadeca-1,9t-diene-11,13-diyn-8-ol
(1R,2S,4S)-2-(1-Hydroxy-6-methylheptyl)-4-hydroxymethylbutanolide|Dihydro-5-(hydroxymethyl)-3-(1-hydroxy)-2(3H)-furanone
(2Z,9Z)-heptadecadiene-4,6-diyn-1-ol|Heptadeca-2c,9c-dien-4,6-diin-1-ol|heptadeca-2c,9c-diene-4,6-diyn-1-ol|Heptadeca-2c.9c-dien-4.6-diin-1-ol
(Z)-9,16-Heptadecadiene-4,6-diyn-3-ol|Heptadeca-4,6-diin-Z-9,16-dien-3-ol|heptadeca-9c,16-diene-4,6-diyn-3-ol
2, 3-Dihydroenanthetol|2,3-dihydrooenanthetol|2.3-Dihydro-oenanthetol|heptadeca-8t,10t-diene-4,6-diyn-1-ol
(all-E)-4,8,10,16-Heptadecatetraen-6-yn-3-ol|heptadeca-4t,8t,10t,16-tetraen-6-yn-3-ol|Heptadecatetraen-(1,7t,9t,13t)-in-(11)-ol-(15)|Heptadecatetraen-(1.7trans.9trans.13trans)-in-(11)-ol-(15)
(2Z,7E,9E,13E)-2,7,9,13-Heptadecatetraen-11-yn-1-ol|heptadeca-2c,7t,9t,13t-tetraen-11-yn-1-ol|Heptadecatetraen-(2c,7t,97,13t)-in-(11)-ol-(1)|Heptadecatetraen-(2cis.7trans.9trans.13trans)-in-(11)-ol-(1)
(1S,9S)-11-but-3-enyl-7,11-diazatricyclo[7.3.1.0<2,7>]trideca-2,4-dien-6-one
relative retention time with respect to 9-anthracene Carboxylic Acid is 0.234 relative retention time with respect to 9-anthracene Carboxylic Acid is 0.232
C15H20N2O_2H-Pyrido[1,2-a]pyrazin-1(6H)-one, hexahydro-3-(phenylmethyl)-, (3S,9aS)
TRIDECANEDIOIC ACID
An alpha,omega-dicarboxylic acid that is undecane substituted by carboxylic acid groups at positions C-1 and C-11. Tridecanedioic acid is an endogenous metabolite.
CELESTOLIDE
D003358 - Cosmetics CONFIDENCE standard compound; INTERNAL_ID 2447
Sophoramine
Origin: Plant; SubCategory_DNP: Alkaloids derived from lysine, Quinolizidine alkaloids, Sophora alkaloid
Brassylic acid
CONFIDENCE standard compound; INTERNAL_ID 426; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5003; ORIGINAL_PRECURSOR_SCAN_NO 5002 CONFIDENCE standard compound; INTERNAL_ID 426; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5063; ORIGINAL_PRECURSOR_SCAN_NO 5062 CONFIDENCE standard compound; INTERNAL_ID 426; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5052; ORIGINAL_PRECURSOR_SCAN_NO 5051 CONFIDENCE standard compound; INTERNAL_ID 426; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5103; ORIGINAL_PRECURSOR_SCAN_NO 5099 CONFIDENCE standard compound; INTERNAL_ID 426; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5016; ORIGINAL_PRECURSOR_SCAN_NO 5015 Tridecanedioic acid is an endogenous metabolite.
N-Leucyl-leucine; AIF; CE0; CorrDec
C12H24N2O3 (244.17868339999998)
N-Leucyl-leucine; AIF; CE10; CorrDec
C12H24N2O3 (244.17868339999998)
N-Leucyl-leucine; AIF; CE30; CorrDec
C12H24N2O3 (244.17868339999998)
N-Leucyl-leucine; AIF; CE0; MS2Dec
C12H24N2O3 (244.17868339999998)
N-Leucyl-leucine; AIF; CE10; MS2Dec
C12H24N2O3 (244.17868339999998)
N-Leucyl-leucine; AIF; CE30; MS2Dec
C12H24N2O3 (244.17868339999998)
6E,8E,12E,14E-Hexadecatetraen-10-ynoic acid
6-Methoxy-4a-methyl-3,4,4a,9,10,10a-hexahydro-2(1H)-phenanthrenone
14-METHOXY-4,4-BISNOR-8,11,13-PODOCARPATRIEN-3-ONE
2-Hydroxymyristic acid
A derivative of myristic acid having a hydroxy substituent at C-2.
Ile-ile
C12H24N2O3 (244.17868339999998)
A dipeptide formed from two L-isoleucine residues.
Ile-leu
C12H24N2O3 (244.17868339999998)
A dipeptide formed from L-isoleucine and L-leucine residues.
Leu-ile
C12H24N2O3 (244.17868339999998)
A dipeptide formed from L-leucine and L-isoleucine residues.
Esperone
D003358 - Cosmetics
3-laevo-menthoxy-2-methyl propane-1,2-diol
Falcarinol
Panaxynol is a long-chain fatty alcohol. It has a role as a metabolite. Falcarinol is a natural product found in Chaerophyllum aureum, Cussonia arborea, and other organisms with data available. A natural product found in Panax ginseng and Angelica japonica.
2-(3-CYCLOPROPYLPHENYL)-4,4,5,5-TETRAMETHYL-[1,3,2]DIOXABOROLANE
C15H21BO2 (244.16345160000003)
(S)-2-(3-(TERT-BUTYL)-3-METHYLUREIDO)-3,3-DIMETHYLBUTANOIC ACID
C12H24N2O3 (244.17868339999998)
2-ETHYL-5-METHYLPYRAZINE
2-ethyl-5-methylpyrazine, 9ci, 8ci, also known as 2,5-methylethylpyrazine or fema 3154, is a member of the class of compounds known as pyrazines. Pyrazines are compounds containing a pyrazine ring, which is a six-member aromatic heterocycle, that consists of two nitrogen atoms (at positions 1 and 4) and four carbon atoms. 2-ethyl-5-methylpyrazine, 9ci, 8ci is soluble (in water) and a moderately basic compound (based on its pKa). 2-ethyl-5-methylpyrazine, 9ci, 8ci is a sweet, bean, and coffee tasting compound and can be found in a number of food items such as cereals and cereal products, fenugreek, coffee and coffee products, and tea, which makes 2-ethyl-5-methylpyrazine, 9ci, 8ci a potential biomarker for the consumption of these food products.
(S)-1-N-Boc-piperazine-3-carboxylicacid methylester
tert-Butyl 4-(2-aminoethyl)-4-hydroxypiperidine-1-carboxylate
C12H24N2O3 (244.17868339999998)
(2E,4E)-5-(4-methoxy-2,3,6-trimethylphenyl)-3-methylpenta-2,4-dienal
2-(4-(tert-Butoxycarbonyl)piperazin-1-yl)acetic acid
METHYL (2R,4R)-4-AMINOPYRROLIDINE-2-CARBOXYLATE, N1-BOC PROTECTED
1-(Triisopropylsilyloxy)cyclopropylmethanol
C13H28O2Si (244.18584680000004)
METHYL-(2-PYRROLIDIN-1-YLMETHYL-1,2,3,4-TETRAHYDRO-NAPHTHALEN-2-YL)-AMINE
Fenestrel
C147908 - Hormone Therapy Agent > C548 - Therapeutic Hormone > C483 - Therapeutic Estrogen
3-Benzyl-7-methyl-3,7-diazabicyclo[3.3.1]nonan-9-one
4-METHYL-BETA-STYRYLBORONIC ACID PINACOL ESTER
C15H21BO2 (244.16345160000003)
2-(4-(TERT-BUTOXYCARBONYL)PIPERAZIN-2-YL)ACETIC ACID
1-BOC-3-(2-METHOXYETHYLAMINO)PYRROLIDINE
C12H24N2O3 (244.17868339999998)
1-BOC-4-AMINOMETHYL-4-METHOXYPIPERIDINE
C12H24N2O3 (244.17868339999998)
(4R,5R)-4,5-Di(dimethylaminocarbonyl)-2,2-dimethyldioxolane, 99+\\%
(E)-1-(1-(FURAN-2-YL)PROP-1-EN-2-YL)CYCLOPROPANAMINE
2,3-Dihydro-1H-inden-5-boronic acid, pinacol ester
C15H21BO2 (244.16345160000003)
Methyl (2R,4R)-1-Boc-4-aminopyrrolidine-2-carboxylate
4,4-Difluorocyclohexene-1-boronic acid pinacol ester
C12H19BF2O2 (244.14460880000001)
6-butyl-1,1,4,4-tetramethyl-2,3-dihydronaphthalene
(2S,4R)-4-(aminomethyl)-1-(tert-butoxycarbonyl)pyrrolidine-2-carboxylic acid
1-(1H-PYRAZOL-5-YL)ETHAN-1-ONEHYDROCHLORIDE
C12H24N2O3 (244.17868339999998)
2-CYCLOPENTYL-5-HYDROXY-6,7-DIMETHYL-2,3-DIHYDRO-1H-INDEN-1-ONE
2-INDANYLBORONIC ACID PINACOL ESTER
C15H21BO2 (244.16345160000003)
4,4,5,5-tetramethyl-2-[(E)-2-(2-methylphenyl)ethenyl]-1,3,2-dioxaborolane
C15H21BO2 (244.16345160000003)
1,4-Dimethyl-3-[4-(2-methyl-2-propanyl)phenyl]-1H-pyrazol-5-ol
1-Piperazinecarboxylicacid, 4-(3-hydroxypropyl)-, 1,1-dimethylethyl ester
C12H24N2O3 (244.17868339999998)
(2S,4S)-4-(aminomethyl)-1-(tert-butoxycarbonyl)pyrrolidine-2-carboxylic acid
(2R,4S)-1-tert-Butyl 2-methyl 4-aminopyrrolidine-1,2-dicarboxylate
2-dimethylamino-5,6-dimethyl-4-pyrimidinyl dimethyl-d6-carbamate
4-(Cyclopropyl)phenylboronic acid pinacol ester
C15H21BO2 (244.16345160000003)
1-tert-Butyl 4-methyl piperazine-1,4-dicarboxylate
3-(TERT-BUTOXYCARBONYLAMINO)PIPERIDINE-3-CARBOXYLIC ACID
(2R,3R)-3-phenyl-2-(pyrrolidin-1-ylmethyl)piperidine
4-Methyl-piperazine-1,2-dicarboxylic acid 1-tert-butyl ester
N-[2-(1H-Indol-3-yl)ethyl]-2,2-dimethylpropanamide
1-BOC-3-(3-METHOXY-PROPYLAMINO)-AZETIDINE
C12H24N2O3 (244.17868339999998)
1-[trans-4-(5-methyl-1,3-benzoxazol-2-yl)cyclohexyl]methanamine(SALTDATA: FREE)
(2S,4S)-1-tert-Butyl 2-methyl 4-aminopyrrolidine-1,2-dicarboxylate
(R)-1-tert-Butyl 3-methyl piperazine-1,3-dicarboxylate
(2S,4R)-METHYL 4-(TERT-BUTOXYCARBONYLAMINO)PYRROLIDINE-2-CARBOXYLATE
tert-butyl 4-(2-amino-1-hydroxyethyl)piperidine-1-carboxylate
C12H24N2O3 (244.17868339999998)
isoaminile
R - Respiratory system > R05 - Cough and cold preparations > R05D - Cough suppressants, excl. combinations with expectorants C78273 - Agent Affecting Respiratory System > C66917 - Antitussive Agent D019141 - Respiratory System Agents > D000996 - Antitussive Agents D002491 - Central Nervous System Agents
4-(2-hydroxy-propyl)-piperazine-1-carboxylic acid tert-butyl ester
C12H24N2O3 (244.17868339999998)
1-tert-Butyl 3-methyl piperazine-1,3-dicarboxylate
bicyclo[2.2.1]hepta-2,5-diene,ethene,(4E)-hexa-1,4-diene,prop-1-ene
(2R,4S)-2-Phenyl-2-isopropyl-4-(dimethylamino)pentanenitrile
13-Hydroxytetradecanoic acid
An (omega-1)-hydroxy fatty acid that is myristic acid in which one of the methylene hydrogens at position 13 is replaced by a hydroxy group.
2-Hydroxyethyl laurate
D013501 - Surface-Active Agents > D011092 - Polyethylene Glycols D001697 - Biomedical and Dental Materials
1,1,3,3,5-Pentamethyl-2,4,4a,9b-tetrahydropyrido[4,3-b]indole
2-(3-Methylbut-2-enyl)-5-(2-methylbut-3-en-2-yl)cyclohexa-2,5-diene-1,4-dione
A natural product found in Sporochnus comosus and Perithalia capillaris.
Leu-leu
C12H24N2O3 (244.17868339999998)
A dipeptide formed from two L-leucine residues. Leu-Leu-OH, a Leu derivative, is a dipeptide.
N-(6-Aminohexanoyl)-6-aminohexanoate
C12H24N2O3 (244.17868339999998)
(3R,4R)-4-(hydroxymethyl)-3-[(1R)-1-hydroxyoctyl]oxolan-2-one
Dihydro-4alpha-(hydroxymethyl)-3beta-[(R)-6-methyl-1-hydroxyheptyl]furan-2(3H)-one
N-(3-aminopropyl)-N-hydroxydecanamide
C13H28N2O2 (244.21506680000002)
[3-Carboxy-2-(3-methylbut-2-enoyloxy)propyl]-trimethylazanium
(8R,9R,10S,13S,14S)-13-Methyl-1,4,5,6,7,8,9,10,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthrene
[3-Carboxy-2-(2-methylidenebutanoyloxy)propyl]-trimethylazanium
(3-Carboxy-2-pent-4-enoyloxypropyl)-trimethylazanium
[3-carboxy-2-[(E)-pent-2-enoyl]oxypropyl]-trimethylazanium
[(2R)-3-carboxy-2-[(E)-2-methylbut-2-enoyl]oxypropyl]-trimethylazanium
[3-carboxy-2-[(E)-pent-3-enoyl]oxypropyl]-trimethylazanium
(2R)-2-hydroxytetradecanoic acid
A 2-hydroxymyristic acid having 2R-configuration.
(2S)-1-[(2S)-2,6-bis(azaniumyl)hexanoyl]pyrrolidine-2-carboxylate
(13R)-13-hydroxymyristic acid
An (omega-1)-hydroxy fatty acid that is myristic acid in which the 13-pro-R hydrogen is replaced by a hydroxy group.
5-(2-Amino-4-methylphenyl)imino-3,3-dimethylcyclohexan-1-one
N,N-diethyl-2-(5-phenyl-1,2-oxazol-3-yl)ethanamine
[3-carboxy-2-[(E)-2-methylbut-2-enoyl]oxypropyl]-trimethylazanium
8-Methylnonanoic acid trimethylsilyl ester
C13H28O2Si (244.18584680000004)
2,3,4,5-Tetrahydro-1,1,3,3-tetramethyl-1H-pyrido[4,3-b]indol-8-ol
6-Methoxy-2,2,4-trimethyl-1,2,3,4-tetrahydro-gamma-carboline
xylometazoline
R - Respiratory system > R01 - Nasal preparations > R01A - Decongestants and other nasal preparations for topical use > R01AB - Sympathomimetics, combinations excl. corticosteroids R - Respiratory system > R01 - Nasal preparations > R01A - Decongestants and other nasal preparations for topical use > R01AA - Sympathomimetics, plain S - Sensory organs > S01 - Ophthalmologicals > S01G - Decongestants and antiallergics > S01GA - Sympathomimetics used as decongestants C78272 - Agent Affecting Nervous System > C29747 - Adrenergic Agent > C87053 - Adrenergic Agonist C308 - Immunotherapeutic Agent > C29578 - Histamine-1 Receptor Antagonist D019141 - Respiratory System Agents > D014663 - Nasal Decongestants D002317 - Cardiovascular Agents > D014662 - Vasoconstrictor Agents
(1R)-3-(3-Butenyl)-1,2,3,4,5,6-hexahydro-1,5-methano-8H-pyrido[1,2-a][1,4]diazocin-8-one
Rhombifoline is an alkaloid isolated for the first time from the leaves and stems of A. foetida L.[1]. Rhombifoline is an alkaloid isolated for the first time from the leaves and stems of A. foetida L.[1].
Leu-Leu zwitterion
C12H24N2O3 (244.17868339999998)
An L-aminoacyl-L-amino acid zwitterion resulting from transfer of a proton from the carboxy to the amino group of L-leucyl-L-leucine; major species at pH 7.3.
N-(6-aminohexanoyl)-6-aminohexanoic acid zwitterion
C12H24N2O3 (244.17868339999998)
Zwitterionic form N-(6-aminohexanoyl)-6-aminohexanoic acid.
Ile-Leu zwitterion
C12H24N2O3 (244.17868339999998)
A dipeptide zwitterion obtained by transfer of a proton from the carboxy to the amino terminus of Ile-Leu.
Lys-Pro(1+)
A peptide cation obtained by deprotonation of the carboxy terminus and protonation of the side-chain amino group and the amino terminus of Lys-Pro; major species at pH 7.3.
(2S)-2-hydroxytetradecanoic acid
A 2-hydroxymyristic acid having 2S-configuration.
(S)-3-hydroxytetradecanoic acid
A C14, long-chain hydroxy fatty acid and enantiomer of the biologically active (R)-3-hydroxytetradecanoic acid.
1-[2-hydroxy-4-(hydroxymethyl)-5,6-dimethyloxan-3-yl]-2-methylbutan-1-one
(2r)-5-[(3-methylbut-2-en-1-yl)oxy]-2-(prop-1-en-2-yl)-2,3-dihydro-1-benzofuran
(1r,9r,10s)-7,15-diazatetracyclo[7.7.1.0²,⁷.0¹⁰,¹⁵]heptadeca-2,4-dien-6-one
ethyl (2r)-2-[(2r,5s)-5-[(2s)-2-hydroxybutyl]oxolan-2-yl]propanoate
7-methoxy-3,5-dimethyl-6-(pent-3-en-1-yl)-1-benzofuran
(2r)-2-methyl-2-(4-methylpent-3-en-1-yl)chromen-6-ol
4b,8,8-trimethyl-5,6,7,8a,9,10-hexahydrophenanthren-2-ol
5-(3-hydroxybut-1-en-1-yl)-4-(hydroxymethyl)-4,6-dimethylcyclohexane-1,3-diol
(6as,10ar)-6,6,9-trimethyl-6ah,7h,8h,10ah-benzo[c]isochromen-2-ol
2-(prop-2-en-1-yl)-1,8-diazatetracyclo[8.3.1.0³,⁸.0³,¹²]tetradec-4-en-7-one
2-[5-(3-hydroxyhexan-2-yl)oxolan-2-yl]propanoic acid
(1s,9s,10r,12s)-4-(methoxymethyl)-9-methyl-13-methylidene-6-oxatetracyclo[7.4.0.0³,⁷.0¹⁰,¹²]trideca-3(7),4-diene
(5s,8r)-8-methoxy-3,4,5-trimethyl-5h,6h,7h,8h-naphtho[2,3-b]furan
methyl 8-isopropyl-5-methyl-3,4-dihydronaphthalene-2-carboxylate
(1s,3s,4r,5s,6r)-5-[(1e,3r)-3-hydroxybut-1-en-1-yl]-4-(hydroxymethyl)-4,6-dimethylcyclohexane-1,3-diol
(2E,9Z)-heptadecadiene-4,6-diyn-1-ol
{"Ingredient_id": "HBIN005578","Ingredient_name": "(2E,9Z)-heptadecadiene-4,6-diyn-1-ol","Alias": "NA","Ingredient_formula": "C17H24O","Ingredient_Smile": "CCCCCCCC=CCC#CC#CC=CCO","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "42447","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
(3S,SR,6R,7E;9S)-megastiman-7-ene-3,5,6,9-tetrol
{"Ingredient_id": "HBIN009731","Ingredient_name": "(3S,SR,6R,7E;9S)-megastiman-7-ene-3,5,6,9-tetrol","Alias": "NA","Ingredient_formula": "C13H24O4","Ingredient_Smile": "CC(C=CC1(C(CC(CC1(C)O)O)(C)C)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "42641","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
alcarinol
{"Ingredient_id": "HBIN015093","Ingredient_name": "alcarinol","Alias": "NA","Ingredient_formula": "C17H24O","Ingredient_Smile": "CCCCCCCC=CCC#CC#CC(C=C)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "33314","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
anagyrine
{"Ingredient_id": "HBIN015975","Ingredient_name": "anagyrine","Alias": "FYU1U980Q9; 5-24-03-00410 (Beilstein Handbook Reference); (1R,9R,10R)-7,15-DIAZATETRACYCLO[7.7.1.0(2),?.0(1)?,(1)?]HEPTADECA-2,4-DIEN-6-ONE; BRN 0086776; ANAGYRINE; (-)-Anagyrine; UNII-FYU1U980Q9; 7,7a,8,9,10,11,13,14-Octahydro-7,14-memethano-4H,6H-dipyrido(1,2-a:1',2'-e)(1,5)diazocin-4-one; 3,4,5,6-Tetradehydrospartein-2-one; (7alpha)-11,12,13,14-tetradehydrospartein-15-one; (-)-anagyrine; CHEMBL509692; Rhombinine; Anagyrine; AC1LE9O5; NSC76019; ZINC900282; Monolupine; 486-89-5","Ingredient_formula": "C15H20N2O","Ingredient_Smile": "C1CCN2CC3CC(C2C1)CN4C3=CC=CC4=O","Ingredient_weight": "244.33 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "SMIT01268;SMIT05719","TCMID_id": "1134","TCMSP_id": "MOL003687;MOL006571","TCM_ID_id": "6815;17611","PubChem_id": "71056954","DrugBank_id": "NA"}