Exact Mass: 292.1455
Exact Mass Matches: 292.1455
Found 500 metabolites which its exact mass value is equals to given mass value 292.1455
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
16-epivellosimine
16-epivellosimine is a member of the class of compounds known as macroline alkaloids. Macroline alkaloids are alkaloids with a structure that is based on the tetracyclic macroline skeleton. The macroline skeleton arises by scission of the C-21 to N-4 bond of the akuammilan skeleton, and mostly occurs in bisindole alkaloids. 16-epivellosimine is practically insoluble (in water) and an extremely weak acidic compound (based on its pKa). 16-epivellosimine can be found in a number of food items such as bitter gourd, red raspberry, orange bell pepper, and star anise, which makes 16-epivellosimine a potential biomarker for the consumption of these food products.
SB 206553
D002492 - Central Nervous System Depressants > D014149 - Tranquilizing Agents > D014151 - Anti-Anxiety Agents D002491 - Central Nervous System Agents > D011619 - Psychotropic Drugs > D014149 - Tranquilizing Agents D018377 - Neurotransmitter Agents > D018490 - Serotonin Agents > D012702 - Serotonin Antagonists D002491 - Central Nervous System Agents > D002492 - Central Nervous System Depressants
Velosimine
An indole alkaloid that is sarpagan in which the methyl group attached to position 16 has been oxidised to the corresponding aldehyde.
11,12-Dimethoxydihydrokawain
11,12-Dimethoxydihydrokawain is found in beverages. 11,12-Dimethoxydihydrokawain is a constituent of Piper methysticum (kava). FDA advises against use of kava in food due to potential risk of severe liver damage (2002)
Phenylbutyrylglutamine
Phenylbutyrylglutamine has been identified as a new metabolite of phenylbutyrate in human plasma and urine. Phenylbutyrate is used in humans for treating inborn errors of ureagenesis, certain forms of cancer, cystic fibrosis and thalassemia. After administration of phenylbutyrate to normal humans, the cumulative urinary excretion of phenylacetate, phenylbutyrate, phenylacetylglutamine and phenylbutyrylglutamine amounts to about half of the dose of phenylbutyrate. [HMDB] Phenylbutyrylglutamine has been identified as a new metabolite of phenylbutyrate in human plasma and urine. Phenylbutyrate is used in humans for treating inborn errors of ureagenesis, certain forms of cancer, cystic fibrosis and thalassemia. After administration of phenylbutyrate to normal humans, the cumulative urinary excretion of phenylacetate, phenylbutyrate, phenylacetylglutamine and phenylbutyrylglutamine amounts to about half of the dose of phenylbutyrate.
Coriandrone A
Constituent of Coriandrum sativum (coriander). Coriandrone A is found in coriander and herbs and spices. Coriandrone A is found in coriander. Coriandrone A is a constituent of Coriandrum sativum (coriander).
Fusarochromanone
Fusarochromanone is found in animal foods. Fusarochromanone is a mycotoxin produced by Fusarium roseum and the cereal fungus Fusarium equiseti (Fusarium graminearum). Affects growth and development of poultry. Mycotoxin production by Fusarium roseum and the cereal fungus Fusarium equiseti (Fusarium graminearum). Affects growth and development of poultry. Fusarochromanone is found in animal foods.
Coriandrone B
Constituent of Coriandrum sativum (coriander). Coriandrone B is found in coriander and herbs and spices. Coriandrone B is found in coriander. Coriandrone B is a constituent of Coriandrum sativum (coriander).
Histidylhistidine
Histidylhistidine is a dipeptide composed of two histidine 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.
Mono-(2-ethyl-5-oxohexyl) phthalate
Mono-(2-ethyl-5-oxohexyl) phthalate, also known as 2-{[(2-ethyl-5-oxohexyl)oxy]carbonyl}benzoic acid, mono(2-Ethyl-5-oxohexyl) phthalate or phthalate mono(2-ethyl-5-oxohexyl) ester, is classified as a member of the benzoic acid esters. Benzoic acid esters are ester derivatives of benzoic acid. Mono-(2-ethyl-5-oxohexyl) phthalate is considered to be practically insoluble (in water) and acidic. (ChemoSummarizer). Mono-(2-ethyl-5-oxohexyl) phthalate is a metabolite of mono(2-ethylhexyl) phthalate (MEHP) and a secondary metabolite of di(2-ethylhexyl) phthalate (DEHP).
Cladosporin
D004791 - Enzyme Inhibitors
11b,13-Dihydrolactucin
11b,13-dihydrolactucin is slightly soluble (in water) and a very weakly acidic compound (based on its pKa). 11b,13-dihydrolactucin can be found in a number of food items such as endive, chicory, dandelion, and romaine lettuce, which makes 11b,13-dihydrolactucin a potential biomarker for the consumption of these food products.
vellosimine
Vellosimine is a member of the class of compounds known as macroline alkaloids. Macroline alkaloids are alkaloids with a structure that is based on the tetracyclic macroline skeleton. The macroline skeleton arises by scission of the C-21 to N-4 bond of the akuammilan skeleton, and mostly occurs in bisindole alkaloids. Vellosimine is practically insoluble (in water) and an extremely weak acidic compound (based on its pKa). Vellosimine can be found in a number of food items such as caraway, italian oregano, star anise, and fox grape, which makes vellosimine a potential biomarker for the consumption of these food products.
Curvularin
3-Methyl-1-morpholinopyrido[1,2-a]benzimidazole-4-carbonitrile
8-(2-hydroxy-3-methoxy-3-methylbutyl)-7-methoxy-1-benzopyran-2-one
3-methoxytanapartholide|3-O-methyl-iso-secotanapartholide|3beta-methoxyisosecotanapartholide|Iso-seco-tanapartholide-3-O-methyl ether
O1-((Xi)-1-methyl-hexyl)-beta-D-glucopyranuronic acid|O1-((Xi)-1-Methyl-hexyl)-beta-D-glucopyranuronsaeure
(+)-7-methoxy-6-(2R-methoxy-3-hydroxy-3-methylbutyl)coumarin
1alpha-hydroxy-9alpha,5beta-epoxy-4,10-dimethyl-6-oxo-7-(1-carbomethoxy-ethyliden)-cyclodeca-7Z,9Z-diene
4-[(2E)-but-2-enoyl]-2-[(1E,3E)-5-hydroxyhexa-1,3-dien-1-yl]-5-methoxy-2-methylfuran-3(2H)-one|penicilliol A
botryosphaerin A|rel-(3aS,5aR,10aS,10bS,10cR)-1,2,3,3a,5a,7,10,10a,10b,10c-decahydro-10a-hydroxy-3a,10b-dimethyl-4H,9H-[2]benzofuro[7,1-fg]isochrome-4,9-dione
15-nor-1beta,4alpha,13,14-tetrahydroxy-8,11,13-podocarpatrien-7-one
4beta-hydroperoxy-9-alpha-methoxy-5alphaH-guaia-1(10),3,11(13)-trien-12,6alpha-olide
Me ester-(1(10)E,4Z,8xi)-8-Hydroxy-1(10),4,7(11)-germacratrien-12,8-olid-15-oic acid
(1aSR,6SR,7RS,7aRS,7bSR)-1a-acetyl-1a,2,4,5,6,7,7a,7b-octahydro-7,7a-dimethyl-2-oxonaphtho[1,2-b]oxiren-6-yl acetate|3beta-(acetyloxy)-6alpha,7alpha-epoxy-11-noreremophil-9(10)-ene-8,11-dione
Me ester-(1(10)E,4Z,6alpha)-15-Hydroxy-1(10),4,11(13)-germacratrien-12,6-olid-14-oic acid|Methyl 15-hydroxygermacra-1(10)E,4Z,11(13)-trien-6alpha,12-olide-14-oic acid
O1-(1-isopropyl-2-methyl-propyl)-beta-D-glucopyranuronic acid|O1-(1-Isopropyl-2-methyl-propyl)-beta-D-glucopyranuronsaeure
Ac- 9,10-Dihydro-2-hydroxy-1,6-dimethyl-7-vinylphenanthrene
1-(trans-4-hydroxycinnamoylamino)-3-hydroxy-4-guanidinobutane|p-coumaroyl-3-hydroxyagmatine
4-[(1E)-3-hydroxyprop-1-en-1-yl]-2,6-dimethoxyphenyl (2Z)-2-methylbut-2-enoate|nervolan B
Asperentin
A member of the class of isocoumarins that is 6,8-dihydroxy-3,4-dihydro-1H-isochromen-1-one substituted by a [6-methyltetrahydro-2H-pyran-2-yl]methyl group at position 3. It has been isolated from the fungus Chaetomium globosum and Aspergillus flavus. D004791 - Enzyme Inhibitors
ferulic acid hexan-3-onyl ether|trans-ferulic acid-O-hexan-3-onyl ether
3-O-demethyl-3-epidiatretol|lepistamide B|rel-(3R,6R)-3,6-dihydroxy-3-(2-methylpropyl)-6-(phenylmethyl)piperazine-2,5-dione
1beta,8beta-epoxy-2alpha-methoxy-6-oxogermacra-9(10), 7(11)-dien-8,12-olide
(2S,3S,4R,5R)-2,5-epoxy-3,4-dimethyl-8,9,10-trimethoxy-6,11-benzocycloheptan-1-one|gymnothedelignan B
(-)-17,18-dehydroeburnamonine|17,18-dehydro-14,15-dihydroeburnamenin-14-one|17,18-dehydrovincamone|Delta14-vincamone
(1aR,4S,4aR,8aR,9aS)-2,3,4,4a,8a,9-hexahydro-8a-methoxy-4,4a,6-trimethyl-1aH-oxireno[8,8a]naphtho[2,3-b]furan-5,7-dione|1beta,10beta-epoxy-8alpha-methoxy-6-oxoeremophil-7(11)-en-12,8beta-olide
7-methoxy-8-(2-methoxy-3-hydroxy-3-methylbutyl)coumarin
3-<(N-acetyl-L-seryl)amino>-3,6-dideoxy-D-glucose|3-[(N-acetyl-L-seryl)amino]-3,6-dideoxy-D-glucose
6-Methoxy-7-(2-hydroxy-3,3-dimethylbutoxy)coumarin
3-(5,7-dimethoxy-2,2-dimethyl-chromen-6-yl)propanoic acid
1beta-acetoxy-8beta-hydroxyeudesmen-4(15),7(11)-dien-8alpha,12-olide
11-hydroxy-3,8-dioxo-eudesman-1,4-dien-12-oic acid methyl ester
2-(3-Methylene-7-methyl-1-oxo-4,7-epidioxyoctane-1-yl)-1,4-benzenediol
(4-methyl-3-oxo-pentyl)-ferulate|<4-methyl-3-oxo-pentyl>-ferulate
8beta-methoxy-eremophil-7(11)-en-6alpha,15;8alpha,12-diolide|8beta-methoxyeremophil-7(11)-en-6alpha,15;8alpha,12-diolide|8beta-methoxyeremophil-7(11)-ene-12,8alpha(4beta,6alpha)-diolide
[4-(1-acetyloxyprop-2-enyl)-2-methoxyphenyl] 2-methylpropanoate
2-[2-(3,4-dimethoxyphenyl)ethyl]-4-methoxy-2,3-dihydropyran-6-one
8-(2-hydroxy-3-methoxy-3-methylbutyl)-7-methoxychromen-2-one
2-[2-(3,4-dimethoxyphenyl)ethyl]-4-methoxy-2,3-dihydropyran-6-one
8-(2-hydroxy-3-methoxy-3-methylbutyl)-7-methoxychromen-2-one
[4-(1-acetyloxyprop-2-enyl)-2-methoxyphenyl] 2-methylpropanoate
Nor-C-fluorocurarine
Origin: Plant; SubCategory_DNP: Monoterpenoid indole alkaloids, Bisindole alkaloids, Indole alkaloids, Curare alkaloids
2-[2-(3,4-dimethoxyphenyl)ethyl]-4-methoxy-2,3-dihydropyran-6-one [IIN-based: Match]
2-[2-(3,4-dimethoxyphenyl)ethyl]-4-methoxy-2,3-dihydropyran-6-one [IIN-based on: CCMSLIB00000847919]
8-(2-hydroxy-3-methoxy-3-methylbutyl)-7-methoxychromen-2-one_major
[4-(1-acetyloxyprop-2-enyl)-2-methoxyphenyl] 2-methylpropanoate_major
His-his
A dipeptide formed from two L-histidine residues.
Coriandrone A
Coriandrone B
4-(1-Acetyloxypropen-2-yl-)-2-methoxyphenylisobutyrat
2-Methoxy-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl acetate
(2S,5S)-1-(2-(1,3-Dioxolan-2-yl)phenyl)-2,5-diethylphospholane
TRANS-1-(TERT-BUTOXYCARBONYL)-4-(PYRIDIN-2-YL)PYRROLIDINE-3-CARBOXYLIC ACID
4-(cyclohexylamino)-3-nitro-benzoic acid ethyl ester
(2S)-2-Amino-4-methylpentanoic acid - (2S)-2-amino-5-methoxy-5-ox opentanoic acid (1:1) (non-preferred name)
tert-butyl 2,2-difluoro-1-oxa-4,9-diazaspiro[5.5]undecane-9-carboxylate
(3R,4S)-1-(tert-Butoxycarbonyl)-4-(pyridin-4-yl)pyrrolidine-3-carboxylic acid
Methyl 2-methoxy-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoate
N,4-Dimethyl-N-(4-nitrophenyl)-1-piperazineacetamide
METHENAMINE MANDELATE
D000890 - Anti-Infective Agents > D000892 - Anti-Infective Agents, Urinary > D008333 - Mandelic Acids C254 - Anti-Infective Agent > C255 - Urinary Anti-Infective Agent D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents
2-(2-ethylhexylaminomethyl)pyridine dihydrochloride
7-O-tert-butyl 3-O-methyl 6,8-dihydro-5H-1,7-naphthyridine-3,7-dicarboxylate
ethyl 6-(2-cyclopentylethyl)imidazo[2,1-b]thiazole-5-carboxylate
(1-((2-(TRIMETHYLSILYL)ETHOXY)METHYL)-1H-PYRROLO[2,3-B]PYRIDIN-2-YL)BORONIC ACID
6-Tert-Butyl 2-Methyl 7,8-Dihydro-1,6-Naphthyridine-2,6(5H)-Dicarboxylate
3-[(Dimethylamino)methyl]-1,2,3,9-tetrahydro-9-methyl-4H-carbazol-4-one hydrochloride
methyl 3-methoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoate
3-(methyl(2-morpholinoethyl)carbamoyl)benzoic acid
2-methylprop-2-enamide,trimethyl-[2-(2-methylprop-2-enoyloxy)ethyl]azanium,chloride
N-ethyl-2-nitro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline
3-methoxy-4-methoxycarbonylphenylboronic acid pinacol ester
methyl 4-methoxy-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoate
4-(2-HYDRAZONO-2-(PYRIDIN-2-YL)ETHYL)-7-METHOXYQUINOLINE
(alphaR)-alpha-[[[2-(4-Aminophenyl)ethyl]amino]methyl]benzenemethanol hydrochloride
1H-Pyrrolo[2,3-b]pyridine-5-carboxylicacid,1-[[2-(triMethylsilyl)ethoxy]Methyl]-
3-hydroxy-N-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-3-yl]propanamide
(2,3-DIHYDROBENZO[B][1,4]DIOXIN-2-YL)(4-(2-HYDROXYETHYL)PIPERAZIN-1-YL) METHANONE
METHYL (2S,4S)-4-(BENZYLOXYCARBONYLAMINO)PIPERIDINE-2-CARBOXYLATE
5-METHYL-1-(3-PYRIDYLCARBAMOYL)-1,2,3,5-TETRAHYDROPYRROLO [2,3-F]INDOLE
D002492 - Central Nervous System Depressants > D014149 - Tranquilizing Agents > D014151 - Anti-Anxiety Agents D002491 - Central Nervous System Agents > D011619 - Psychotropic Drugs > D014149 - Tranquilizing Agents D018377 - Neurotransmitter Agents > D018490 - Serotonin Agents > D012702 - Serotonin Antagonists D002491 - Central Nervous System Agents > D002492 - Central Nervous System Depressants
ZD7288
D020011 - Protective Agents > D002316 - Cardiotonic Agents D002317 - Cardiovascular Agents
acetic acid, [2-acetyl-5-[(3-methyl-2-butenyl)oxy]phenoxy]-, methyl ester
3,5:6,7-Di-O-isopropylidene-D-glycero-D-gulo-heptitol
2-{2-[(2S,5S)-2,5-diethyl-1-phospholano]phenyl}1,3-dioxolane, min. 97
N,N-Dimethyl-2-nitro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline
8-N-BOC-5,6,7,8-TETRAHYDRO-1,8-NAPHTHYRIDIN-2-ACETIC ACID
tert-butyl 3,3-dimethyl-6-nitro-2H-indole-1-carboxylate
7-amino-2-[(2-methylpropan-2-yl)oxycarbonyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid
1-(3,6-diphenyl-1H-1,2,4,5-tetrazin-2-yl)propan-1-one
4-(n-Acetylamino)-3-[n-(2-ethylbutanoylamino)]benzoic acid
16-epivellosimine
An indole alkaloid that is vellosimine in which the carbon bearing the aldehyde function has been epimerised.
1-[2-(1H-indol-3-yl)ethyl]-5,6,7,8-tetrahydroquinolin-4-one
Bifluranol
C147908 - Hormone Therapy Agent > C547 - Hormone Antagonist > C242 - Anti-Androgen
13,15-Dihydroxy-5-methyl-4-oxabicyclo[10.4.0]hexadeca-1(12),13,15-triene-3,11-dione
D009676 - Noxae > D011042 - Poisons > D009183 - Mycotoxins
S-[1-(2-hydroxyethyl)-1-methylbutyl]-(l)-cysteinylglycine
(1S,12S,13S,14S,15E)-15-ethylidene-3,17-diazapentacyclo[12.3.1.02,10.04,9.012,17]octadeca-2(10),4,6,8-tetraene-13-carbaldehyde
N-(3-Hydroxy-4-guanidinobutyl)-3-(4-hydroxyphenyl)propenamide
(15E)-15-ethylidene-3,17-diazapentacyclo[12.3.1.02,10.04,9.012,17]octadeca-2(10),4,6,8-tetraene-13-carbaldehyde
[3-Carboxy-2-(3-carboxy-2-hydroxybutanoyl)oxypropyl]-trimethylazanium
3-O-methyl-isosecotanapartholide
A sesquiterpene lactone that is isosecotanapartholide in which the hydroxy group at position 3 is replaced by a methoxy group. Isolated from Artemisia iwayomogi and Tanacetum cilicicum, it acts as an inhibitor of nitric oxide synthase.
2H-Pyran-2-one, 6-[2-(3,4-dimethoxyphenyl)ethyl]-5,6-dihydro-4-methoxy-, (S)-
N-(4,5-dihydrothiazol-2-yl)-3,5-dimethyl-1-adamantanecarboxamide
2-(benzotriazol-1-yl)-N-(2,3-dihydro-1H-inden-2-yl)acetamide
5-Amino-1-(2-hydroxyethyl)-3-(1-naphthalenylmethyl)-4-pyrazolecarbonitrile
4-[(1-Ethyl-6-methyl-4-pyrazolo[3,4-b]pyridinyl)oxymethyl]benzonitrile
2-[(2-Acetamido-1-oxoethyl)amino]-3-phenylpropanoic acid ethyl ester
5-(cyclohexylmethyl)-3-thiophen-2-yl-1H-pyridazin-6-one;hydrate
1-(4-Methoxyphenyl)-2-(1-methyl-2-isoquinolin-2-iumyl)ethanone
(3S,6R)-6-[(2R,3R,5R,6S)-3,5-dihydroxy-6-methyloxan-2-yl]oxy-3-hydroxyheptanoic acid
(3R)-7-[(2R,3R,5R,6S)-3,5-dihydroxy-6-methyloxan-2-yl]oxy-3-hydroxyheptanoic acid
(1R,5S)-3-methylsulfonyl-7-[4-[(E)-prop-1-enyl]phenyl]-3,6-diazabicyclo[3.1.1]heptane
2-[4-[(1E,8E)-deca-1,8-dienyl]-2,5-dioxofuran-3-yl]acetic acid
3,4-Dimethyl-1,1-DI(para-tolyl)-1-silacyclopent-3-ene
mono(2-Ethyl-5-oxohexyl) phthalate
A phthalic acid monoester obtained by formal condensation of one of the carboxy groups of phthalic acid with the hydroxy group of 2-ethyl-5-oxohexan-1-ol.
(1r,7r,9r,10s,12s,14r)-7-methoxy-4,9,14-trimethyl-6,11,15-trioxapentacyclo[8.5.0.0¹,¹⁴.0³,⁷.0¹⁰,¹²]pentadec-3-en-5-one
13-ethylidene-8,15-diazapentacyclo[10.5.1.0¹,⁹.0²,⁷.0¹⁰,¹⁵]octadeca-2,4,6,8-tetraene-18-carbaldehyde
10,14-dimethyl-3,6,16-trioxapentacyclo[8.6.1.0²,⁴.0⁴,⁹.0¹⁴,¹⁷]heptadecane-7,15-dione
3-oxohexyl (2e)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate
13-ethylidene-9,15-diazapentacyclo[10.5.2.0²,¹¹.0³,⁸.0¹⁵,¹⁸]nonadeca-2(11),3,5,7,9-pentaen-1-ol
(1s,12r,13z,18s)-13-ethylidene-9,15-diazapentacyclo[10.5.2.0²,¹¹.0³,⁸.0¹⁵,¹⁸]nonadeca-2(11),3,5,7,9-pentaen-1-ol
12,14-dihydroxy-3-methyl-4,5,6,7,8,10-hexahydro-3h-2-benzoxacyclododecine-1,9-dione
10,10-dimethyl-5-(3-methylbut-3-en-1-yn-1-yl)-2,6,9-trioxatetracyclo[6.4.0.0¹,³.0⁵,⁷]dodecane-4,11-diol
methyl (2s)-2-[(2s,4ar)-4a,8-dimethyl-3,7-dioxo-2,4-dihydro-1h-naphthalen-2-yl]-2-hydroxypropanoate
(2s)-2-[2-(2,5-dihydroxyphenyl)-2-oxoethyl]-6-methylhept-5-enoic acid
(4s,11s)-4-(2-hydroxypropan-2-yl)-7-methoxy-11-methyl-3,12-dioxatricyclo[7.4.0.0²,⁶]trideca-1(9),2(6),7-trien-13-one
(4ar,5s,8as,9s,9ar)-9-hydroxy-9a-methoxy-3,4a,5-trimethyl-4h,5h,8ah,9h-naphtho[2,3-b]furan-2,8-dione
2-{1h,2h,3h,4h-indolo[2,3-a]quinolizin-2-yl}but-3-en-1-ol
2-(deca-4,6,8-triyn-1-yloxy)-6-methyloxane-3,4,5-triol
methyl 2-[(5r,6r,7as)-6-ethenyl-7a-hydroxy-3,6-dimethyl-2-oxo-5,7-dihydro-4h-1-benzofuran-5-yl]prop-2-enoate
(3as,4ar,5r,9ar)-3a,5-dihydroxy-9a-methoxy-4a,5-dimethyl-3-methylidene-2h,4h-naphtho[2,3-b]furan-6-one
8-hydroxy-1,12-dimethyl-5,10-dioxatetracyclo[7.6.1.0²,⁷.0¹²,¹⁶]hexadec-2-ene-4,11-dione
9-hydroxy-9a-methoxy-3,4a,5-trimethyl-4h,5h,8ah,9h-naphtho[2,3-b]furan-2,8-dione
methyl 3-methyl-12-methylidene-13-oxo-4,14-dioxatricyclo[9.3.0.0³,⁵]tetradec-8-ene-8-carboxylate
(1r,7s,9s,10s,12s,14r)-7-methoxy-4,9,14-trimethyl-6,11,15-trioxapentacyclo[8.5.0.0¹,¹⁴.0³,⁷.0¹⁰,¹²]pentadec-3-en-5-one
4-[(1z)-3-(acetyloxy)prop-1-en-1-yl]-2-methoxyphenyl 2-methylpropanoate
methyl (1'r,2r,5's,8'r)-3',3'-dimethyl-11'-oxo-10'-oxaspiro[oxirane-2,12'-tricyclo[6.4.0.0¹,⁵]dodecan]-6'-ene-7'-carboxylate
(4s,5s)-5-[(3r)-3-methoxy-2-methyl-5-oxocyclopent-1-en-1-yl]-3-methylidene-4-(3-oxobutyl)oxolan-2-one
1,4-dimethyl 2-(4-hydroxyphenyl)-3-(2-methylpropyl)but-2-enedioate
(11s,12z,17s)-12-ethylidene-8,14-diazapentacyclo[9.5.2.0¹,⁹.0²,⁷.0¹⁴,¹⁷]octadeca-2,4,6,9-tetraene-10-carbaldehyde
(11s,12e)-12-ethylidene-8,14-diazapentacyclo[9.5.2.0¹,⁹.0²,⁷.0¹⁴,¹⁷]octadeca-2,4,6,9-tetraene-10-carbaldehyde
1,4-dihydroxy-2-(7'-methyl-3'-methylene-1'-oxo-4',7'-peroxide-octyl)benzene
{"Ingredient_id": "HBIN001430","Ingredient_name": "1,4-dihydroxy-2-(7'-methyl-3'-methylene-1'-oxo-4',7'-peroxide-octyl)benzene","Alias": "NA","Ingredient_formula": "C16H20O5","Ingredient_Smile": "CC1(CCC(OO1)C(=C)CC(=O)C2=C(C=CC(=C2)O)O)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "6040","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
1-o-coumaroylglycerol; (s,e)-form,4'-me ether,2,3-o-isopropylidene
{"Ingredient_id": "HBIN002874","Ingredient_name": "1-o-coumaroylglycerol; (s,e)-form,4'-me ether,2,3-o-isopropylidene","Alias": "NA","Ingredient_formula": "C16H20O5","Ingredient_Smile": "NA","Ingredient_weight": "292.33","OB_score": "NA","CAS_id": "220852-55-1","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "9134","PubChem_id": "NA","DrugBank_id": "NA"}
2,7-dimethoxy-1,6-dimethyl-5-vinylphenan-threne
{"Ingredient_id": "HBIN005023","Ingredient_name": "2,7-dimethoxy-1,6-dimethyl-5-vinylphenan-threne","Alias": "NA","Ingredient_formula": "C20H20O2","Ingredient_Smile": "CC1=C(C=CC2=C1C=CC3=CC(=C(C(=C32)C=C)C)OC)OC","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "6222","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
3-methoxytanapartholide
{"Ingredient_id": "HBIN008858","Ingredient_name": "3-methoxytanapartholide","Alias": "NA","Ingredient_formula": "C16H20O5","Ingredient_Smile": "CC1=C(C(=O)CC1OC)C2C(C(=C)C(=O)O2)CCC(=O)C","Ingredient_weight": "292.33 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "14090","TCMSP_id": "NA","TCM_ID_id": "11786;11787;17223;17224","PubChem_id": "14527156","DrugBank_id": "NA"}
7-methoxy-8-(2'-methoxy-3'-hydroxy-3'3methylbutyl)coumarin
{"Ingredient_id": "HBIN013329","Ingredient_name": "7-methoxy-8-(2'-methoxy-3'-hydroxy-3'3methylbutyl)coumarin","Alias": "NA","Ingredient_formula": "C16H20O5","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "31560","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
7-methoxy-8-(2'-methoxy-3'-hydroxy-3’-methyl-butyl)coumarin
{"Ingredient_id": "HBIN013330","Ingredient_name": "7-methoxy-8-(2'-methoxy-3'-hydroxy-3\u2019-methyl-butyl)coumarin","Alias": "NA","Ingredient_formula": "C16H20O5","Ingredient_Smile": "CC(C)(C(CC1=C(C=C2C(=C1)C=CC(=O)O2)OC)OC)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "13989","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}