Exact Mass: 216.18779039999998
Exact Mass Matches: 216.18779039999998
Found 500 metabolites which its exact mass value is equals to given mass value 216.18779039999998,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Atractylon
Atractylone is a sesquiterpenoid. Atractylon is a natural product found in Eugenia uniflora, Prumnopitys andina, and other organisms with data available.
Furanodiene
Furanodiene is a germacrane sesquiterpenoid. Furanodiene is a natural product found in Curcuma amada, Lactarius chrysorrheus, and other organisms with data available. Furanodiene is a constituent of Curcuma zedoaria (zedoary) Constituent of Curcuma zedoaria (zedoary)
12-Hydroxydodecanoic acid
12-hydroxydodecanoic acid is the substrate of the human glutathione-dependent formaldehyde dehydrogenase (EC1.1.1.1). The enzyme that catalyzes the conversion of alcohols to aldehydes is a zinc-containing dimeric enzyme responsible for the oxidation of long-chain alcohols and omega-hydroxy fatty acids. (OMIM). The human glutathione-dependent formaldehyde dehydrogenase is unique among the structurally studied members of the alcohol dehydrogenase family in that it follows a random bi kinetic mechanism forming a binary complex, and a ternary complex with NAD+. (PMID 12196016). 12-hydroxydodecanoic acid is the substrate of the human glutathione-dependent formaldehyde dehydrogenase (EC1.1.1.1) . The enzyme that catalyzes the conversion of alcohols to aldehydes is a zinc-containing dimeric enzyme responsible for the oxidation of long-chain alcohols and omega-hydroxy fatty acids. (OMIM) 12-Hydroxydodecanoic acid is an endogenous metabolite.
7-hydroxylauric acid
A hydroxy fatty acid comprising lauric acid carrying a single hydroxy substituent at position 7.
Isogermafurene
Isogermafurene is found in herbs and spices. Isogermafurene is isolated from Curcuma zedoaria (zedoary), present to some extent in nearly all Curcuma species. Isolated from Curcuma zedoaria (zedoary), present to some extent in nearly all Curcuma subspecies Isogermafurene is found in herbs and spices. Curzerene is a natural product found in Commiphora myrrha and Lindera pulcherrima var. hemsleyana with data available.
(R)-ar-Turmerone
(R)-ar-Turmerone is found in herbs and spices. (R)-ar-Turmerone is a constituent of essential oil from Curcuma longa (turmeric), Curcuma amada (mango-ginger) Constituent of essential oil from Curcuma longa (turmeric), Curcuma amada (mango-ginger). (R)-ar-Turmerone is found in turmeric and herbs and spices. ar-Turmerone ((+)-ar-Turmerone) is a major bioactive compound of the herb Curcuma longa with anti-tumorigenesis and anti-inflammatory activities[1][2][3]. ar-Turmerone activates apoptotic protein in human lymphoma U937 cells[3]. ar-Turmerone exerts positive modulation on murine DCs. ar-Turmerone induces NSC proliferation and constitutes a promising therapeutic agent for various neurologic disorders[4][5]. ar-Turmerone ((+)-ar-Turmerone) is a major bioactive compound of the herb Curcuma longa with anti-tumorigenesis and anti-inflammatory activities[1][2][3]. ar-Turmerone activates apoptotic protein in human lymphoma U937 cells[3]. ar-Turmerone exerts positive modulation on murine DCs. ar-Turmerone induces NSC proliferation and constitutes a promising therapeutic agent for various neurologic disorders[4][5].
Valylvaline
Valylvaline is a dipeptide composed of two valine residues. It is an incomplete breakdown product of protein digestion or protein catabolism. Dipeptides are organic compounds containing a sequence of exactly two alpha-amino acids joined by a peptide bond. 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. H-VAL-VAL-OH is a dipeptide of the amino acid valine, an essential amino acid[1].
3-hydroxylaurate
3-Hydroxydodecanoic acid (CAS: 1883-13-2) is a medium-chain fatty acid associated with fatty acid metabolic disorders (PMID: 11948802). Deficiency of medium-chain acyl-CoA dehydrogenase is characterized by an intolerance to prolonged fasting, recurrent episodes of hypoglycemic coma with medium-chain dicarboxylic aciduria, impaired ketogenesis, and low plasma and tissue carnitine levels (OMIM: 201450). 3-Hydroxydodecanoic acid is also a microbial metabolite found in Acinetobacter, Moraxella, and Pseudomonas (PMID: 21687748). 3-Hydroxydodecanoic acid has been identified in the human placenta (PMID: 32033212). 3-Hydroxydodecanoic acid is a medium-chain fatty acid associated with fatty acid metabolic disorders (PMID 11948802). Deficiency of medium-chain acyl-CoA dehydrogenase is characterized by intolerance to prolonged fasting, recurrent episodes of hypoglycemic coma with medium-chain dicarboxylic aciduria, impaired ketogenesis, and low plasma and tissue carnitine levels. (OMIM 201450) [HMDB] 3-Hydroxydodecanoic acid is a medium-chain fatty acid associated with fatty acid metabolic disorders.
1,3,5,11-Bisabolatetraen-10-one
1,3,5,11-Bisabolatetraen-10-one is found in herbs and spices. 1,3,5,11-Bisabolatetraen-10-one is a constituent of oil of Cinnamomum cassia (Chinese cinnamon) Constituent of oil of Cinnamomum cassia (Chinese cinnamon). 1,3,5,11-Bisabolatetraen-10-one is found in herbs and spices.
1,2-Dehydro-alpha-cyperone
1,2-Dehydro-alpha-cyperone is found in coffee and coffee products. 1,2-Dehydro-alpha-cyperone is a constituent of Lycium chinense (Chinese boxthorn). Constituent of Lycium chinense (Chinese boxthorn). 1,2-Dehydro-alpha-cyperone is found in tea, coffee and coffee products, and herbs and spices.
2-Hexyl-3-phenyl-2-propenal
2-Hexyl-3-phenyl-2-propenal is a flavouring agent Flavouring agent α-Hexylcinnamaldehyde, a compound derived from Cinnamaldehyde. α-Hexylcinnamaldehyde has the potential antimutagenic and chemosensitizing properties. α-Hexylcinnamaldehyde is widely used as an ingredient in many personal care, and as an additive in food and the pharmaceutical industry[1].
(R)-3-Hydroxydodecanoic acid
In humans fatty acids are predominantly formed in the liver and adipose tissue, and mammary glands during lactation.(R)-3-Hydroxydodecanoic acid is an intermediate in fatty acid biosynthesis. Specifically,(R)-3-Hydroxydodecanoic acid is converted from 3-Oxo-Dodecanoic acid via two enzymes; fatty-acid Synthase and 3-oxoacyl-[acyl-carrier-protein] reductase (EC: 2.3.1.85 and EC: 1.1.1.100) [HMDB] In humans fatty acids are predominantly formed in the liver and adipose tissue, and mammary glands during lactation.(R)-3-Hydroxydodecanoic acid is an intermediate in fatty acid biosynthesis. Specifically,(R)-3-Hydroxydodecanoic acid is converted from 3-Oxo-Dodecanoic acid via two enzymes; fatty-acid Synthase and 3-oxoacyl-[acyl-carrier-protein] reductase (EC: 2.3.1.85 and EC: 1.1.1.100). 12-Hydroxydodecanoic acid is an endogenous metabolite.
Heptanoylcholine
Heptanoylcholine is a fatty acid-choline as the ester product of Heptanoic acid and cholinel. The pharmacological effects of a series of fatty acid-choline esters have been studied on the isolated rabbit heart, the isolated guinea-pig ileum and the rat stomach. The effect changed with increasing chain length, and three different types of response were observed. The shortchain compounds produced depression of the isolated rabbit heart and spasm of the isolated guinea-pig ileum. Only one, butyrylcholine, had an erratic stimulating effect on hydrochloric acid secretion by the partially vagotomized rat stomach. Medium-chain compounds had a stimulating effect on the isolated rabbit heart, a mixed spasmogenic and relaxant effect on the isolated guinea-pig ileum, and no effect on the rat stomach. Long-chain compounds blocked the effect of acetylcholine on the isolated rabbit heart and the isolated guinea-pig ileum; they also depressed spontaneous hydrochloric acid secretion by the rat stomach. Heptanoylcholine is a fatty acid-choline as the ester product of Heptanoic acid and cholinel.
Acetaldehyde hexyl isoamyl acetal
Acetaldehyde hexyl isoamyl acetal is used as a food additive [EAFUS] ("EAFUS: Everything Added to Food in the United States. [http://www.eafus.com/]")
Valeraldehyde dibutyl acetal
Valeraldehyde dibutyl acetal 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 .
5beta-1,3,7(11)-Eudesmatrien-8-one
5beta-1,3,7(11)-Eudesmatrien-8-one is found in fruits. 5beta-1,3,7(11)-Eudesmatrien-8-one is a constituent of Eugenia uniflora (Surinam cherry) Constituent of Eugenia uniflora (Surinam cherry). 5beta-1,3,7(11)-Eudesmatrien-8-one is found in fruits.
Cyperotundone
Cyperotundone is found in root vegetables. Cyperotundone is a constituent of Cyperus rotundus (nutgrass). Constituent of Cyperus rotundus (nutgrass). Cyperotundone is found in root vegetables.
xi-5-Hydroxydodecanoic acid
Present as triglycerides in milk and butterfat. xi-5-Hydroxydodecanoic acid is found in milk and milk products. xi-5-Hydroxydodecanoic acid is found in milk and milk products. Present as triglycerides in milk and butterfat.
1,10-Oxidocalamenene
1,10-Oxidocalamenene belongs to the family of Sesquiterpenes. These are terpenes with three consecutive isoprene units
N-OMEGA-PROPYL-L-ARGININE
C9H20N4O2 (216.15861800000002)
n-propyl-l-arginine
C9H20N4O2 (216.15861800000002)
Dehydronootkatone
It is used as a food additive .
(E,E)-2-(2,6-Dimethyl-2,5,7-octatrienyl)-4-methylfuran
Debromoaplysin
(E,E)-2-(2,6-Dimethyl-1,5,7-octatrienyl)-4-methylfuran
Propanoic acid 2-methyl-3-hydroxy-2,4,4-trimethylpentyl ester
Debromolaurinterol
A sesquiterpenoid that is laurinterol in which the bromo group has been replaced by a hydrogen. Isolated from Laurencia intermedia and Aplysia kurodai, it exhibits antimicrobial activity.
(E,Z)-2-(2,6-Dimethyl-1,5,7-octatrienyl)-4-methylfuran
(Z,E)-2-(2,6-Dimethyl-2,5,7-octatrienyl)-4-methylfuran
(5E)-3,6-dimethyl-10-methylene-4,7,8,9,10,11-hexahydrocyclodecafuran|(5E)-3,6-dimethyl-10-methylene-4,7,8,9,10,11-hexahydrocyclodeca[b]furan
2-(1,2-Dimethylbicyclo[3.1.0]hexane-2-yl)-5-methylphenol
(2Z,9Z)-pentadecadiene-4,6-diyn-1-ol|(Z,Z)-2,9-Pentadecadiene-4,6-diyn-1-ol|2Z-9Z-pentadecadiene-4,6-diyn-1-ol|pentadeca-2c,9c-diene-4,6-diyn-1-ol
(+)-trans-calamenen-13-al|(5S,8R)-5,6,7,8-tetrahydro-5-methyl-8-(1-methylethyl)naphthalene-2-carbaldehyde
Cyclopentanone, 3,3,4-trimethyl-4-(4-methylphenyl)-
(6S,10S)-3,10-dimethyl-7,11-dimethylidenespiro[5,5]undec-2-en-4-one
7-methyl-7-(4-methylpenta-1,3-dienyl)-4,5,6,7-tetrahydrobenzofuran
2-(1,2-Dimethyl-3-methylenecyclopentyl)-5-methylphenol
(all-E)-1,4,8,10-Pentadecatetraen-6-yn-3-ol|Pentadeca-1,4t,8t,10t-tetraen-6-in-3-ol|pentadeca-1,4t,8t,10t-tetraen-6-yn-3-ol
2-Methyl-5-(1,2,3-trimethyl-2-cyclopentenyl)phenol
(4S)-3,4-dihydro-6-methyl-4-(1-methylethyl)naphthalene-1-methanol|(7S)-alpha-calacoren-14-ol
(13E)-13-Pentadecene-9,11-diyn-6-one|(E)-13-Pentadecene-9,11-diyn-6-one|pentadeca-trans-2-ene-4,6-diyn-10-one
(7E,13E)-7,13-Pentadecadiene-9,11-diyn-6-ol|(E,E)-27,13-Pentadecadiene-9,11-diyn-6-ol|pentadeca-7t,13t-diene-9,11-diyn-6-ol|pentadeca-trans-2,trans-8-diene-4,6-diyn-10-ol|Pentadecadien-(2t,8t)-diin-(4,6)-ol-(10)|trans.trans-Pentadecadien-(2.8)-diin-(4.6)-ol-(10)
(3E,6E)-form-3-(4,8-Dimethyl-3,6,8-nonatrienyl)furan
Propanoic acid, 2-methyl-, 3-hydroxy-2,4,4-trimethylpentyl ester
ar-Turmerone
(+)-(S)-ar-turmerone is a sesquiterpenoid that is 2-methylhept-2-en-4-one substituted by a 4-methylphenyl group at position 6. It has been isolated from Peltophorum dasyrachis. It has a role as an EC 3.1.1.7 (acetylcholinesterase) inhibitor and a plant metabolite. It is a sesquiterpenoid and an enone. ar-Turmerone is a natural product found in Curcuma amada, Curcuma longa, and other organisms with data available. A sesquiterpenoid that is 2-methylhept-2-en-4-one substituted by a 4-methylphenyl group at position 6. It has been isolated from Peltophorum dasyrachis. Ar-turmerone, also known as aromatic-turmerone, is a member of the class of compounds known as sesquiterpenoids. Sesquiterpenoids are terpenes with three consecutive isoprene units. Ar-turmerone is practically insoluble (in water) and an extremely weak basic (essentially neutral) compound (based on its pKa). Ar-turmerone can be found in turmeric, which makes ar-turmerone a potential biomarker for the consumption of this food product. ar-Turmerone ((+)-ar-Turmerone) is a major bioactive compound of the herb Curcuma longa with anti-tumorigenesis and anti-inflammatory activities[1][2][3]. ar-Turmerone activates apoptotic protein in human lymphoma U937 cells[3]. ar-Turmerone exerts positive modulation on murine DCs. ar-Turmerone induces NSC proliferation and constitutes a promising therapeutic agent for various neurologic disorders[4][5]. ar-Turmerone ((+)-ar-Turmerone) is a major bioactive compound of the herb Curcuma longa with anti-tumorigenesis and anti-inflammatory activities[1][2][3]. ar-Turmerone activates apoptotic protein in human lymphoma U937 cells[3]. ar-Turmerone exerts positive modulation on murine DCs. ar-Turmerone induces NSC proliferation and constitutes a promising therapeutic agent for various neurologic disorders[4][5].
12-Hydroxydodecanoic acid
12-Hydroxydodecanoic acid is an endogenous metabolite.
3Alpha-Hydroxy-4,4-Bisnor-8,11,13-Podocarpatriene_major
Omega-hydroxydodecanoate
12-Hydroxydodecanoic acid is an endogenous metabolite.
(+)-Vulgraon B
A sesquiterpene that is tricyclo[5.4.0.0(2,8)]undec-9-ene substituted by methyl groups at positions 2, 6, 6, and 9 as well as a methylidene group at position 11.
Val-val
A dipeptide formed from two L-valine residues. H-VAL-VAL-OH is a dipeptide of the amino acid valine, an essential amino acid[1].
&alpha
α-Hexylcinnamaldehyde, a compound derived from Cinnamaldehyde. α-Hexylcinnamaldehyde has the potential antimutagenic and chemosensitizing properties. α-Hexylcinnamaldehyde is widely used as an ingredient in many personal care, and as an additive in food and the pharmaceutical industry[1].
Ar-tumerone
ar-Turmerone ((+)-ar-Turmerone) is a major bioactive compound of the herb Curcuma longa with anti-tumorigenesis and anti-inflammatory activities[1][2][3]. ar-Turmerone activates apoptotic protein in human lymphoma U937 cells[3]. ar-Turmerone exerts positive modulation on murine DCs. ar-Turmerone induces NSC proliferation and constitutes a promising therapeutic agent for various neurologic disorders[4][5]. ar-Turmerone ((+)-ar-Turmerone) is a major bioactive compound of the herb Curcuma longa with anti-tumorigenesis and anti-inflammatory activities[1][2][3]. ar-Turmerone activates apoptotic protein in human lymphoma U937 cells[3]. ar-Turmerone exerts positive modulation on murine DCs. ar-Turmerone induces NSC proliferation and constitutes a promising therapeutic agent for various neurologic disorders[4][5].
5beta-1,3,7(11)-Eudesmatrien-8-one
1,2-Dehydro-a-cyperone
Silane, (1,1-dimethylethyl)[(1-ethoxycyclopropyl)oxy]dimethyl- (9CI)
3-[4-(1,1-Dimethylpropyl)phenyl]-2-methyl-2-propenal
1-Piperazinecarboxylicacid, 4-(3-hydroxypropyl)-, ethyl ester
TERT-BUTYL ((3R,5R)-5-(HYDROXYMETHYL)PYRROLIDIN-3-YL)CARBAMATE HYDROCHLORIDE
(4aR,7aR)-octahydro-6-(phenylmethyl)-1H-Pyrrolo[3,4-b]pyridine
tert-butyl 3-amino-4-(hydroxymethyl)pyrrolidine-1-carboxylate
Carbamicacid,N-[(3S,5S)-5-(hydroxymethyl)-3-pyrrolidinyl]-,1,1-dimethylethylester
(R)-TERT-BUTYL (1-AMINO-3-METHYL-1-OXOBUTAN-2-YL)CARBAMATE
tert-butyl 3-amino-4-hydroxypiperidine-1-carboxylate
[1-({[Dimethyl(2-methyl-2-propanyl)silyl]oxy}methyl)cyclopropyl]m ethanol
Carbamic acid, [4-(ethylamino)butyl]-, 1,1-dimethylethyl ester (9CI)
1H-Benzimidazole,2-(2,2-dimethylpropyl)-1-ethyl-(9CI)
(1R,5S)-endo-8-Benzyl-8-azabicyclo[3.2.1]octan-3-amine
tert-Butyl 2-(tetrahydro-2H-pyran-4-yl)hydrazinecarboxylate
tert-butyl 3-(aminomethyl)-4-hydroxypyrrolidine-1-carboxylate
(2S,4S)-1-BOC-2-hydroxyMethyl-4-amino Pyrrolidine-HCl
(1-hydroxy-2,4,4-trimethylpentan-3-yl) 2-methylpropanoate
tert-butyl (2R)-2-(hydroxymethyl)piperazine-1-carboxylate
tert-butyl 2-(hydroxymethyl)piperazine-1-carboxylate
(s,s)-6-benzyl-octahydro-pyrrolo[3,4-b]pyridine dihydrochloride
tert-butyl 4-(2-hydroxyethyl)piperazine-1-carboxylate
(2R,4S)-1-BOC-2-HYDROXYMETHYL-4-AMINOPYRROLIDINE HYDROCHLORIDE
(R)-3-(Aminomethyl)morpholine-4-carboxylic acid tert-butyl ester
2-(1,1-Dimethylethyl)-3-(1-methylethyl)-2H-indazole
TRANS-TERT-BUTYL 3-AMINO-4-METHOXYPYRROLIDINE-1-CARBOXYLATE
(7-BENZYL-7-AZABICYCLO[2.2.1]HEPTAN-1-YL)METHANAMINE
tert-butyl (3R,5S)-5-(hydroxymethyl)pyrrolidin-3-ylcarbamate
tert-butyl (2S)-2-(hydroxymethyl)piperazine-1-carboxylate
.cents.cis-2,8-diaza-2-benzyl-bicyclo[4.3.0]nonane
{3-[(tert-butyldimethylsilyl)oxy]cyclobutyl}methanol
tert-butyl (S)-2-((aminooxy)methyl)pyrrolidine-1-carboxylate
(2R,4S)-2-Hydroxymethyl-4-Boc-aminopyrrolidine hydrochloride
1-Azabicyclo[2.2.2]octan-3-amine,N-(phenylmethyl)-
3,4-dihydro-1H-spiro[cyclohexane-1,2-quinolin]-7-aMine
1H-Inden-1-one, 5-(1,1-dimethylethyl)-2,3-dihydro-3,3-dimethyl-
1H-Inden-1-one, 7-(1,1-dimethylethyl)-2,3-dihydro-3,3-dimethyl-
Furanodiene
532-65-0
ar-Turmerone ((+)-ar-Turmerone) is a major bioactive compound of the herb Curcuma longa with anti-tumorigenesis and anti-inflammatory activities[1][2][3]. ar-Turmerone activates apoptotic protein in human lymphoma U937 cells[3]. ar-Turmerone exerts positive modulation on murine DCs. ar-Turmerone induces NSC proliferation and constitutes a promising therapeutic agent for various neurologic disorders[4][5]. ar-Turmerone ((+)-ar-Turmerone) is a major bioactive compound of the herb Curcuma longa with anti-tumorigenesis and anti-inflammatory activities[1][2][3]. ar-Turmerone activates apoptotic protein in human lymphoma U937 cells[3]. ar-Turmerone exerts positive modulation on murine DCs. ar-Turmerone induces NSC proliferation and constitutes a promising therapeutic agent for various neurologic disorders[4][5].
5-tert-Butyl-3,3-dimethyl-1-indanone
(11R)-11-hydroxylauric acid
An 11-hydroxylauric acid that has R configuration.
(S)-4-hydroxylauric acid
An optically active form of 4-hydroxylauric acid having (S)-configuration.
(R)-4-hydroxylauric acid
An optically active form of 4-hydroxylauric acid having (R)-configuration.
(1S,8S)-4,8,10,10-tetramethyl-9-oxatricyclo[6.2.2.02,7]dodeca-2(7),3,5-triene
(2S,7R)-2,6,6,9-tetramethyl-11-methylidenetricyclo[5.4.0.0(2,8)]undec-9-ene
4-Methyl-2-(5-hydroxy-3-methylpentoxy)-3,4,5,6-tetrahydro-2H-pyran
2,3,4-Trimethylpentanoic acid, trimethylsilyl ester
2-(4-Hydroxy-3,4-dimethylpentoxy)-3,4,5,6-tetrahydro-2H-pyran
4a,6,9a-Trimethyl-1,2,3,4,4a,9a-hexahydro-9H-pyrido[2,3-b]indole
4a,9,9a-Trimethyl-1,2,3,4,4a,9a-hexahydro-9H-pyrido[2,3-b]indole
11-hydroxylauric acid
A medium-chain fatty acid that is lauric acid substituted at position 11 by a hydroxy group.
Hexyl cinnamaldehyde
α-Hexylcinnamaldehyde, a compound derived from Cinnamaldehyde. α-Hexylcinnamaldehyde has the potential antimutagenic and chemosensitizing properties. α-Hexylcinnamaldehyde is widely used as an ingredient in many personal care, and as an additive in food and the pharmaceutical industry[1].
3-Hydroxylauric acid
A medium-chain fatty acid that is the 3-hydroxylated derivative of lauric acid; associated with fatty acid metabolic disorders.
3-hydroxy-2,4,4-trimethylpentyl 2-methylpropanoate
A carboxylic ester resulting from the formal condensation of the carboxy group of isobutyric acid with the 1-hydroxy group of 2,4,4-trimethylpentane-1,3-diol.
9-hydroxylauric acid
A hydroxy fatty acid comprising lauric acid carrying a single hydroxy substituent at position 9.
12-Hydroxylauric acid
A medium-chain fatty acid that is the 12-hydroxylated derivative of lauric acid.
2-Hydroxylauric acid
A monohydroxy fatty acid with a lauric acid core substituted at position 2 by a hydroxy group, which confers chirality; a component of cellular lipids in Pseudomonas strains.
4-hydroxylauric acid
A hydroxy fatty acid comprising lauric acid carrying a hydroxy group at C-4.
(R)-3-hydroxylauric acid
The (R)-enantiomer of 3-hydroxylauric acid. An intermediate in fatty acid biosynthesis.
(1s,5r)-1,10-dimethyl-8-(prop-1-en-2-yl)spiro[4.5]deca-7,9-dien-6-one
(4ar,7r,7as)-4a,7,7a-trimethyl-4-methylidene-5h,6h,7h,8h-indeno[5,6-b]furan
(5r,6r)-6-ethenyl-3,6-dimethyl-5-(prop-1-en-2-yl)-5,7-dihydro-4h-1-benzofuran
4,5-dimethyl-3-(prop-1-en-2-yl)-5,6,7,8-tetrahydronaphthalen-1-ol
2,2,5,9-tetramethyl-1h,7h,8h-cyclopenta[8]annulen-4-one
(6z,10s)-3,6,10-trimethyl-5,8,9,10-tetrahydrobenzo[8]annulen-2-ol
2-[(2s,8s,8ar)-8,8a-dimethyl-2,3,4,6,7,8-hexahydro-1h-naphthalen-2-yl]cycloprop-2-en-1-one
(3r)-2,2,3-trimethyl-3-(4-methylphenyl)cyclopentan-1-one
4,4-dimethyl-7-methylidene-4ah,5h,6h,8h,8ah,9h-naphtho[2,3-b]furan
2-(2,6-dimethylocta-1,5,7-trien-1-yl)-4-methylfuran
(1r,9s)-1,5,12,12-tetramethyl-8-oxatricyclo[7.2.1.0²,⁷]dodeca-2,4,6-triene
(5s)-1,5,8-trimethyl-4h,5h,5ah,6h,7h,9ah-naphtho[2,1-b]furan
(4as,7r)-1,4a-dimethyl-7-(prop-1-en-2-yl)-5,6,7,8-tetrahydronaphthalen-2-one
3,6,10-trimethyl-5,8,9,10-tetrahydrobenzo[8]annulen-2-ol
(3as)-3a-methyl-1-(prop-1-en-2-yl)-3,4,7,8-tetrahydro-2h-azulene-6-carbaldehyde
(4as,8as)-4,4,7-trimethyl-4ah,5h,6h,8ah,9h-naphtho[2,3-b]furan
(10r)-3,6,10-trimethyl-5,8,9,10-tetrahydrobenzo[8]annulen-2-ol
1,1,7,7a-tetramethyl-1ah,6h,7h,7bh-cyclopropa[a]naphthalen-5-one
(4ar,8ar)-4,4-dimethyl-7-methylidene-4ah,5h,6h,8h,8ah,9h-naphtho[2,3-b]furan
(1r,4as,8as)-1,6-dimethyl-4-(prop-1-en-2-yl)-4a,7,8,8a-tetrahydro-1h-naphthalen-2-one
(5s)-4,5-dimethyl-3-(prop-1-en-2-yl)-5,6,7,8-tetrahydronaphthalen-1-ol
(5s)-5-isopropyl-3-methyl-8-methylidene-6,7-dihydro-5h-naphthalen-2-ol
1(10),8-aristoladien-2-one
{"Ingredient_id": "HBIN000222","Ingredient_name": "1(10),8-aristoladien-2-one","Alias": "NA","Ingredient_formula": "C15H20O","Ingredient_Smile": "CC1CC(=O)C=C2C1(C3C(C3(C)C)C=C2)C","Ingredient_weight": "216.32 g/mol","OB_score": "NA","CAS_id": "22391-34-0","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "9724","PubChem_id": "101297625","DrugBank_id": "NA"}
1-(3-cyclopentylpropyl)-2,4-dimethyl-Benzene
{"Ingredient_id": "HBIN001158","Ingredient_name": "1-(3-cyclopentylpropyl)-2,4-dimethyl-Benzene","Alias": "NA","Ingredient_formula": "C16H24","Ingredient_Smile": "CC1=CC(=C(C=C1)CCCC2CCCC2)C","Ingredient_weight": "216.36 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "42054","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "576612","DrugBank_id": "NA"}
(?)-(1s,5r,6r,7s,10s)-myli-4(15)-en-3-one
{"Ingredient_id": "HBIN003302","Ingredient_name": "(?)-(1s,5r,6r,7s,10s)-myli-4(15)-en-3-one","Alias": "NA","Ingredient_formula": "C15H20O","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "15136","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
2,5,5-Trimethyl-3-phenyl-cyclohexanone
{"Ingredient_id": "HBIN004577","Ingredient_name": "2,5,5-Trimethyl-3-phenyl-cyclohexanone","Alias": "NA","Ingredient_formula": "C15H20O","Ingredient_Smile": "CC1C(CC(CC1=O)(C)C)C2=CC=CC=C2","Ingredient_weight": "216.32 g/mol","OB_score": "50.45102568","CAS_id": "NA","SymMap_id": "SMIT05520","TCMID_id": "NA","TCMSP_id": "MOL003456","TCM_ID_id": "NA","PubChem_id": "589263","DrugBank_id": "NA"}
2-ethyl-3-hydroxyhexyl butyrate
{"Ingredient_id": "HBIN005609","Ingredient_name": "2-ethyl-3-hydroxyhexyl butyrate","Alias": "NA","Ingredient_formula": "C12H24O3","Ingredient_Smile": "CCCC(C(CC)COC(=O)CCC)O","Ingredient_weight": "216.32","OB_score": "14.39859115","CAS_id": "18618-89-8","SymMap_id": "SMIT09454","TCMID_id": "NA","TCMSP_id": "MOL008126","TCM_ID_id": "NA","PubChem_id": "347867","DrugBank_id": "NA"}
(.+-.)-2-Methyl-6-p-tolyl-2-hepten-4-ol
{"Ingredient_id": "HBIN006019","Ingredient_name": "(.+-.)-2-Methyl-6-p-tolyl-2-hepten-4-ol","Alias": "NA","Ingredient_formula": "C15H20O","Ingredient_Smile": "CC1=CC=C(C=C1)C(C)CC(=O)C=C(C)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "36748","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
alpha-cuparenone
{"Ingredient_id": "HBIN015473","Ingredient_name": "alpha-cuparenone","Alias": "\u03b1-cuparenone","Ingredient_formula": "C15H20O","Ingredient_Smile": "CC1=CC=C(C=C1)C2(CCC(=O)C2(C)C)C","Ingredient_weight": "216.32 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "30840;4370","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "11106791","DrugBank_id": "NA"}
beta-cuparenone
{"Ingredient_id": "HBIN018035","Ingredient_name": "beta-cuparenone","Alias": "\u03b2-cuparenone","Ingredient_formula": "C15H20O","Ingredient_Smile": "CC1=CC=C(C=C1)C2(CC(=O)CC2(C)C)C","Ingredient_weight": "216.32 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "30841;4371","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "10998446","DrugBank_id": "NA"}
(5s)-5-isopropyl-3,8-dimethyl-5,6-dihydronaphthalen-2-ol
(4as,8s,8ar)-3,8-dimethyl-5-(prop-1-en-2-yl)-4a,7,8,8a-tetrahydro-1h-naphthalen-2-one
(1ar,7ar,7br)-1,1,4,7-tetramethyl-1ah,2h,3h,7ah,7bh-cyclopropa[e]azulen-5-one
(4as,8s,8as)-3,8-dimethyl-5-(prop-1-en-2-yl)-4a,7,8,8a-tetrahydro-1h-naphthalen-2-one
(6r)-3,6,10-trimethyl-6h,7h,8h,11h-cyclodeca[b]furan
3-[(2z,4e,6e)-4,8-dimethylnona-2,4,6-trien-1-yl]furan
(6z,10r)-3,6,10-trimethyl-5,8,9,10-tetrahydrobenzo[8]annulen-2-ol
5-methyl-2-[(2r,3e)-6-methylhepta-3,5-dien-2-yl]phenol
9,10,11-trimethyl-3-oxatricyclo[7.3.1.0²,⁶]trideca-2(6),4,10-triene
(1r,9s,13r)-9,10,13-trimethyl-3-oxatricyclo[7.2.2.0²,⁶]trideca-2(6),4,10-triene
(1as,7ar,7br)-1,1,4,7-tetramethyl-1ah,2h,3h,7ah,7bh-cyclopropa[e]azulen-5-one
2-[(1r,3s)-1,3-dimethyl-2-methylidenecyclopentyl]-5-methylphenol
3,5,8a-trimethyl-4h,4ah,7h,8h,9h-naphtho[2,3-b]furan
3,3,7-trimethyl-12-methylidene-10-oxatricyclo[6.4.0.0²,⁴]dodeca-6,8-diene
(5r)-4,5-dimethyl-3-(prop-1-en-2-yl)-5,6,7,8-tetrahydronaphthalen-1-ol
3a-methyl-1-(prop-1-en-2-yl)-3,4,7,8-tetrahydro-2h-azulene-6-carbaldehyde
(4r)-3,3,4-trimethyl-4-(4-methylphenyl)cyclopentan-1-one
2-methyl-5-(1,2,3-trimethylcyclopent-2-en-1-yl)phenol
1,2,5,8-tetramethyl-1h,2h,6h,7h,8h-indeno[5,4-b]furan
(2r,5r,6r)-2,5,6,10-tetramethyl-7-oxatricyclo[6.4.0.0²,⁶]dodeca-1(12),8,10-triene
(1r,9r)-9,10,11-trimethyl-3-oxatricyclo[7.3.1.0²,⁶]trideca-2(6),4,10-triene
2-(2,6-dimethylocta-2,5,7-trien-1-yl)-4-methylfuran
(4-isopropyl-6-methyl-3,4-dihydronaphthalen-1-yl)methanol
[4-(1,2-dimethyl-3-methylidenecyclopentyl)phenyl]methanol
3-[3-(5,5-dimethylcyclohex-1-en-1-yl)prop-2-en-1-yl]furan
2-{1,2-dimethylbicyclo[3.1.0]hexan-2-yl}-5-methylphenol
2-(4a-methyl-8-methylidene-octahydronaphthalen-2-yl)cycloprop-2-en-1-one
[(4s)-4-isopropyl-6-methyl-3,4-dihydronaphthalen-1-yl]methanol
3,5,8-trimethyl-4h,6h,7h,7ah,8h,9h-azuleno[6,5-b]furan
2,6,6,9-tetramethyl-3-methylidenecycloundeca-1,4,8-triene
(5s,6s)-6-ethenyl-3,6-dimethyl-5-(prop-1-en-2-yl)-5,7-dihydro-4h-1-benzofuran
5,9-dimethyl-2-(propan-2-ylidene)bicyclo[7.1.0]deca-5,7-dien-3-one
9,10,13-trimethyl-3-oxatricyclo[7.2.2.0²,⁶]trideca-2(6),4,10-triene
(5s,5ar,9as)-1,5,8-trimethyl-4h,5h,5ah,6h,7h,9ah-naphtho[2,1-b]furan
(1s,2s,4s)-3,3,7-trimethyl-12-methylidene-10-oxatricyclo[6.4.0.0²,⁴]dodeca-6,8-diene
(1r)-7-isopropyl-1,4-dimethyl-2,3-dihydro-1h-azulen-6-one
1,6-dimethyl-4-(prop-1-en-2-yl)-4a,7,8,8a-tetrahydro-1h-naphthalen-2-one
2-(1,2-dimethyl-3-methylidenecyclopentyl)-5-methylphenol
(5s,5ar,9ar)-1,5,8-trimethyl-4h,5h,5ah,6h,7h,9ah-naphtho[2,1-b]furan
(2r)-6,10-dimethyl-2-(prop-1-en-2-yl)spiro[4.5]deca-6,9-dien-8-one
4a,7,7a-trimethyl-4-methylidene-5h,6h,7h,8h-indeno[5,6-b]furan
3-isopropyl-5,7b-dimethyl-1ah,2h,3h-naphtho[1,2-b]oxirene
(1r,5z,7e,9r)-5,9-dimethyl-2-(propan-2-ylidene)bicyclo[7.1.0]deca-5,7-dien-3-one
{4-[(1r,2s)-1,2-dimethyl-3-methylidenecyclopentyl]phenyl}methanol
8-isopropyl-5-methyl-5,6,7,8-tetrahydronaphthalene-2-carbaldehyde
(1r,10r,13s)-10,11,13-trimethyl-3-oxatricyclo[8.2.1.0²,⁶]trideca-2(6),4,11-triene
3-{[(6r)-6-isopropyl-3-methylidenecyclohex-1-en-1-yl]methyl}furan
(1s,9s)-9,10,11-trimethyl-3-oxatricyclo[7.3.1.0²,⁶]trideca-2(6),4,10-triene
(7as,8r)-3,5,8-trimethyl-4h,6h,7h,7ah,8h,9h-azuleno[6,5-b]furan
(2s,5s,6s)-2,5,6,10-tetramethyl-7-oxatricyclo[6.4.0.0²,⁶]dodeca-1(12),8,10-triene
(5s,8r)-8-isopropyl-5-methyl-5,6,7,8-tetrahydronaphthalene-2-carbaldehyde
2-[(2r,4ar,8as)-4a-methyl-8-methylidene-octahydronaphthalen-2-yl]cycloprop-2-en-1-one
(4ar,8as)-3,8a-dimethyl-5-methylidene-4h,4ah,6h,7h,8h,9h-naphtho[2,3-b]furan
4-methyl-2-(2-methyl-6-methylideneocta-2,7-dien-1-yl)furan
(4r)-4-[(1r,2s,3r)-3-hydroxy-2,3-dimethylcyclopentyl]pentane-1,4-diol
1,1,4,7-tetramethyl-1ah,2h,3h,7ah,7bh-cyclopropa[e]azulen-5-one
3,4a,5-trimethyl-4h,5h,6h,7h,8h-naphtho[2,3-b]furan
3-[(2z,4e,6z)-4,8-dimethylnona-2,4,6-trien-1-yl]furan
(4ar,8ar)-3,5,8a-trimethyl-4h,4ah,7h,8h,9h-naphtho[2,3-b]furan
2-[(2e,5e)-2,6-dimethylocta-2,5,7-trien-1-yl]-4-methylfuran
(2r,3r)-3-hydroxy-2,4,4-trimethylpentyl 2-methylpropanoate
2,2,3-trimethyl-3-(4-methylphenyl)cyclopentan-1-one
(4as,8ar)-4,4,7-trimethyl-4ah,5h,6h,8ah,9h-naphtho[2,3-b]furan
(3r)-3,6-diamino-n-{[(1-hydroxyethylidene)amino]methyl}hexanimidic acid
C9H20N4O2 (216.15861800000002)