Chemical Formula: C17H22O4
Chemical Formula C17H22O4
Found 303 metabolite its formula value is C17H22O4
Epitulipinolide
Epi-tulipinolide is a germacranolide with formula C17H22O4, originally isolated from Liriodendron tulipifera. It exhibits anti-cancer and anti-oxidant properties. It has a role as an antineoplastic agent, an antioxidant and a plant metabolite. It is a germacranolide and an acetate ester. Epitulipinolide is a natural product found in Cassinia aculeata, Ageratina ligustrina, and Liriodendron tulipifera with data available. A germacranolide with formula C17H22O4, originally isolated from Liriodendron tulipifera. It exhibits anti-cancer and anti-oxidant properties.
Tulipinolide
A germacranolide based on a 2,3,3a,4,5,8,9,11a-octahydrocyclodeca[b]furan-4-yl skeleton.
Laurenobiolide
Laurenobiolide is found in herbs and spices. Laurenobiolide is a constituent of Laurus nobilis (bay laurel). Constituent of Laurus nobilis (bay laurel). Laurenobiolide is found in sweet bay and herbs and spices.
1-Dehydro-[6]-gingerdione
1-dehydro-[6]-gingerdione belongs to hydroxycinnamic acids and derivatives class of compounds. Those are compounds containing an cinnamic acid (or a derivative thereof) where the benzene ring is hydroxylated. 1-dehydro-[6]-gingerdione is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). 1-dehydro-[6]-gingerdione can be found in ginger, which makes 1-dehydro-[6]-gingerdione a potential biomarker for the consumption of this food product.
3-Polyprenyl-4,5-dihydroxybenzoate
This compound belongs to the family of Hydroxybenzoic Acid Derivatives. These are compounds containing an hydroxybenzoic acid (or a derivative), which is a benzene ring bearing a carboxylic acid.
Oudemansin A
Oudemansin A is found in mushrooms. Oudemansin A is a metabolite of Oudemansiella mucida (porcelain fungus). Metabolite of Oudemansiella mucida (porcelain fungus). Oudemansin A is found in mushrooms.
[6]-Dehydrogingerdione
[6]-Dehydrogingerdione is found in herbs and spices. [6]-Dehydrogingerdione is isolated from Zingiber officinale (ginger
Dehydrogingerdione
Dehydrogingerdione is a member of the class of compounds known as methoxyphenols. Methoxyphenols are compounds containing a methoxy group attached to the benzene ring of a phenol moiety. Dehydrogingerdione is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Dehydrogingerdione can be found in ginger, which makes dehydrogingerdione a potential biomarker for the consumption of this food product.
Laurenoniolide
Laurenoniolide belongs to germacranolides and derivatives class of compounds. Those are sesquiterpene lactones with a structure based on the germacranolide skeleton, characterized by a gamma lactone fused to a 1,7-dimethylcyclodec-1-ene moiety. Laurenoniolide is practically insoluble (in water) and an extremely weak basic (essentially neutral) compound (based on its pKa). Laurenoniolide can be found in sweet bay, which makes laurenoniolide a potential biomarker for the consumption of this food product.
Tulipinolide
Tulipinolide belongs to germacranolides and derivatives class of compounds. Those are sesquiterpene lactones with a structure based on the germacranolide skeleton, characterized by a gamma lactone fused to a 1,7-dimethylcyclodec-1-ene moiety. Tulipinolide is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Tulipinolide can be found in sweet bay, which makes tulipinolide a potential biomarker for the consumption of this food product.
Acetoxydiplophyllin
3-(Acetyloxy)-5-(1,5-dimethyl-4-hexenyl)-2-methyl-2,5-cyclohexadiene-1,4-dione
9beta-Acetoxytournefortiolide
[1aS-(1aalpha,4alpha,4aalpha,5alpha,9aS*)]-1a,2,4,4a,5,9-Hexahydro-4,4a,6-trimethyl-3H-oxireno[8,8a]naphtho[2,3-b]furan-5-ol acetate
15-Acetoxyisoalloalantolactone
[3aR-(3aR*,5Z,9E,11aS*)]-6-[(Acetyloxy)methyl]-3a,4,7,8,11,11a-hexahydro-10-methyl-3-methylenecyclodeca[b]furan-2(3H)-one
beta-Cyclotulipinolide
3beta-Acetoxy-1(5),11(13)-guaiadien-12,8alpha-olide
2alpha-Acetoxysphaerantholide
1-(5,7-dihydroxy-2,2,6-trimethyl-2H-1-benzopyran-8-yl)-2-methyl-1-butanone|3-Methyl-1-(5,7-Dihydroxy-2,2,6-trimethyl-2H-1-benzopyran-8-yl)-2-methyl-1-propanone
3-(6xi-hydroperoxy-3,7-dimethylocta-2,7-dienyl)-4-hydroxybenzaldehyde
1.beta.-Acetoxyeudesma-4(15),7(11)-dien-8.alpha.,12-olide
(E)-3-(7-hydroperoxy-3,7-dimethylocta-2,5-dienyl)-4-hydroxybenzaldehyde
3,4-dihydroxy-5-[(2E)-4-hydroxy-3-methylbut-2-en-1-yl]-2-(3-methylbut-2-en-1-yl)benzaldehyde|sabphenol B
delta5,6-isomer,Ac-(3bata,8alpha)-3-Hydroxy-1(5),11(13)-guaiadien-12,8-olide
3H-Oxireno[8,8a]naphtho[2,3-b]furan-5-ol, 1a,2,4,4a,5,9-hexahydro-4,4a,6-trimethyl-, acetate
11beta,13-dihydrozaluzanin C acetate|3beta-Acetoxy-11betaH-guaia-4(15),10(14)-diene-12,6alpha-olide
14-acetoxy-11alphaH,13-dihydroeremanthin|Ac-(1alpha,5alpha,6alpha,11alphaH)-14-Hydroxy-4(15),9-guaiadien-12,6-olide
9-acetoxy-thymol 3-O-tiglate|9-Acetoxythymo l3-O-tiglate|9-Acetoxythymol 3-O-tiglate
(3E,7Z)-1-(2,6-dihydroxy-4-methoxyphenyl)-deca-3,7-dien-1-one|syzygiol B
1beta,13,14-trihydroxy-8,11,13-podocarpatrien-7-one|1beta,13,14-trihydroxypodocarpa-8,11,13-trien-7-one|1??,13,14-Trihydroxy-8,11,13-podocarpatrien-7-one
3-hydroxy-2,2,6-trimethyl-3H-spiro[1-benzofuran-2,1-cyclohexane]-5-carboxylic acid
(E)-4-acetoxy-6-methylene-5-(prop-1-en-2-yl)cyclohex-2-enyl 2-methylbut-2-enoate
chermesinone A
An azaphilone that is 7,8-dihydro-6H-isochromene substituted by a hydroxy group at position 7, methyl groups at positions 3 and 7 and a 3-methyl-2-oxopentyl group at position 8. It has been isolated from the culture of the mangrove endophytic fungus Penicillium chermesinum.
(1alpha,3alpha,4alpha,5alpha,8alpha)-15-(acetyloxy)linden-7(11)-eno-12,8-lactone|chlojaponilactone E|rel-(4aR,5-S,5aR,6aS,6bR,7aR)-5-[(acetyloxy)methyl]-4a,5,5a,6,6a,7,7a-octahydro-3,6b-dimethylcloprop[2,3]indeno[5,6-b]furan-2(4H)-one
15alpha-ethoxy-1alphaH,5alphaH,6betaH,7alphaH-3-oxo-10(14),11(13)-guaiadien-6,12-olide|ainsliaolide B
15-acetoxy-isogermafurenolide|2-[3,6-dimethyl-2-oxo-6-vinyl-2,4,5,6,7,7alpha-hexahydro-1-benzofuran-5-yl]prop-2-en-1-yl acetate
Laurenobiolide
A germacranolide isolated from Laurus nobilis L. and which has been shown to exhibit allergenic activity.
3beta,13,14-trihydroxy-8,11,13-podocarpatrien-7-one|3beta,13,14-trihydroxypodocarpa-8,11,13-trien-7-one
6-Isobutyryl-5,7-dimethoxy-2,2-dimethyl-benzopyran
4.Xi.,5.xi.,7.xi.-Guaia-1(10),11(13)-dien-12-oic acid, 4,8-dihydroxy-, .gamma.-lactone, acetate
3-(3-Methyl-2-butenyl)-4-(3-methylbutyryl)oxybenzoic acid
6-Dehydrogingerdione
[6]-Dehydrogingerdione is a hydroxycinnamic acid. [6]-Dehydrogingerdione is a natural product found in Curcuma longa and Zingiber officinale with data available.
C17H22O4_3-(5,9-Dimethyl-4-oxo-8-oxatetracyclo[7.2.1.1~7,10~.0~1,6~]tridec-2-en-5-yl)propanoic acid
C17H22O4_3,8a-Dimethyl-5-methylene-2-oxo-2,4,4a,5,6,7,8,8a,9,9a-decahydronaphtho[2,3-b]furan-8-yl acetate
C17H22O4_(6E,10E)-6,10-Dimethyl-3-methylene-2-oxo-2,3,3a,4,5,8,9,11a-octahydrocyclodeca[b]furan-4-yl acetate
methyl 2-methylprop-2-enoate,2-methylprop-2-enoic acid,styrene
tetrahydrofuran-3-yl 2-cyclopentyl-2-hydroxy-2-phenylacetate
1beta-Acetoxyeudesma-4(15),7(11)-dien-8alpha,12-olide
Platensic Acid
A polycyclic cage attached to a 2-carboxyethyl side chain. It is isolated from Streptomyces platensis.
9-acetoxythymol 3-O-tiglate
A natural product found in Eupatorium cannabinum subspecies asiaticum.
[(4S,5E,9E)-6,10-dimethyl-3-methylidene-2-oxo-2,3,3a,4,7,8,11,11a-octahydrocyclodeca[b]furan-4-yl] acetate
3-[(2E)-3,7-dimethylocta-2,6-dienyl]-4,5-dihydroxybenzoic acid
(5e)-1-(oct-2-en-1-yl)-4-oxo-5-(2-oxoethylidene)cyclopent-2-en-1-yl acetate
3-{3-methoxy-4-[(3-methylbut-2-en-1-yl)oxy]phenyl}prop-2-en-1-yl acetate
(1r,4r,7r,8s,12s)-1-hydroxy-4-methyl-7-(prop-1-en-2-yl)-3,13-dioxatetracyclo[10.2.1.0²,¹⁰.0⁴,⁸]pentadec-2(10)-en-11-one
(3as,9r,11as)-6,10-dimethyl-3-methylidene-2-oxo-3ah,4h,5h,8h,9h,11ah-cyclodeca[b]furan-9-yl acetate
3-[(3,7-dimethylocta-2,6-dien-1-yl)oxy]-4-hydroxybenzoic acid
8a-methyl-3,5-dimethylidene-2-oxo-octahydronaphtho[2,3-b]furan-7-yl acetate
(3as,5ar,6r,9as,9bs)-5a-methyl-3,9-dimethylidene-2-oxo-octahydronaphtho[1,2-b]furan-6-yl acetate
(4s,4as,7s)-4,4a,6-trimethyl-2,8-dioxo-4,7,9,10-tetrahydro-3h-benzo[8]annulen-7-yl acetate
3-hydroxy-1-(4-hydroxy-3-methoxyphenyl)deca-1,3-dien-5-one
5a,9-dimethyl-3-methylidene-2-oxo-3ah,4h,5h,6h,7h,9ah,9bh-naphtho[1,2-b]furan-6-yl acetate
(1s)-1-[3-hydroxy-2-(5-methylhex-4-enoyl)phenyl]ethyl acetate
(3as,4r,8as,9ar)-5,8a-dimethyl-3-methylidene-2-oxo-3ah,4h,6h,7h,8h,9h,9ah-naphtho[2,3-b]furan-4-yl acetate
(2r)-1-(5,7-dihydroxy-2,2,6-trimethylchromen-8-yl)-2-methylbutan-1-one
(3r,5e)-12-hydroxy-14-methoxy-3-methyl-3,4,7,8,9,10-hexahydro-2-benzoxacyclododecin-1-one
(1r,3r,6r,8r,9r)-4-methyl-9-(4-methyl-2-oxopent-3-en-1-yl)-7-oxatricyclo[4.3.0.0³,⁹]non-4-en-8-yl acetate
2,5-dihydroxy-6-methoxy-3-(7-methyl-3-methylideneoct-6-en-1-yn-1-yl)cyclohex-3-en-1-one
(3ar,4s,6s,7s,7ar)-6-ethenyl-6-methyl-3-methylidene-2-oxo-7-(prop-1-en-2-yl)-tetrahydro-3ah-1-benzofuran-4-yl acetate
(1s,4s,7r,8r,12r)-12-hydroxy-4-methyl-7-(prop-1-en-2-yl)-3,14-dioxatetracyclo[10.2.1.0²,¹⁰.0⁴,⁸]pentadec-2(10)-en-11-one
methyl (2e,6e)-8-(2,5-dihydroxyphenyl)-2,6-dimethylocta-2,6-dienoate
3-{[(2e)-3,7-dimethylocta-2,6-dien-1-yl]oxy}-4-hydroxybenzoic acid
(1as,2s,3r,3ar,7br)-3,3a-dimethyl-6-oxo-5-(propan-2-ylidene)-1ah,2h,3h,4h,7bh-naphtho[1,2-b]oxiren-2-yl acetate
12-hydroxy-14-methoxy-3-methyl-3,4,5,6,7,8-hexahydro-2-benzoxacyclododecin-1-one
(2e)-3,7-dimethylocta-2,6-dien-1-yl 3,4-dihydroxybenzoate
(3r)-3-hydroxy-4-[(1r)-4-hydroxy-7-(3-methylbut-2-en-1-yl)-1,3-dihydro-2-benzofuran-1-yl]butan-2-one
3-methyl-6,9-dimethylidene-2-oxo-octahydro-3h-azuleno[4,5-b]furan-8-yl acetate
{6-methyl-3-methylidene-2-oxo-3ah,4h,5h,8h,9h,11ah-cyclodeca[b]furan-10-yl}methyl acetate
(3r,3ar,6ar,9ar,9br)-3-hydroxy-6,9-dimethylidene-3-(2-oxopropyl)-octahydroazuleno[4,5-b]furan-2-one
(3ar,4s,5ar,9bs)-5a,9-dimethyl-3-methylidene-2-oxo-3ah,4h,5h,6h,7h,8h,9bh-naphtho[1,2-b]furan-4-yl acetate
[(4r,4as,7r,7as)-4a,7,7a-trimethyl-5-oxo-4h,6h,7h,8h-indeno[5,6-b]furan-4-yl]methyl acetate
4-hydroxy-4'-methyl-6,9-dimethylidene-octahydrospiro[azuleno[4,5-b]furan-3,2'-oxetan]-2-one
4,6-dihydroxy-5-methoxy-2-(7-methyl-3-methylideneoct-6-en-1-yn-1-yl)cyclohex-2-en-1-one
(3ar,6s,8ar,9ar)-5,8a-dimethyl-3-methylidene-2-oxo-3ah,4h,6h,7h,8h,9h,9ah-naphtho[2,3-b]furan-6-yl acetate
{3-methyl-8-methylidene-2-oxo-3h,3ah,4h,4ah,7h,7ah,9h,9ah-azuleno[6,5-b]furan-5-yl}methyl acetate
12-hydroxy-14-methoxy-3-methyl-3,4,7,8,9,10-hexahydro-2-benzoxacyclododecin-1-one
4-hydroxy-3-(2-hydroxy-3-methylbut-3-en-1-yl)-5-(3-methylbut-2-en-1-yl)benzoic acid
1β,13,14-trihydroxy-8,11,13-podocarpatrien-7-one
{"Ingredient_id": "HBIN002337","Ingredient_name": "1\u03b2,13,14-trihydroxy-8,11,13-podocarpatrien-7-one","Alias": "NA","Ingredient_formula": "C17H22O4","Ingredient_Smile": "CC1(CCC(C2(C1CC(=O)C3=C2C=CC(=C3O)O)C)O)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "21823","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
acetylcannabispiranol
{"Ingredient_id": "HBIN014462","Ingredient_name": "acetylcannabispiranol","Alias": "NA","Ingredient_formula": "C17H22O4","Ingredient_Smile": "NA","Ingredient_weight": "290.358","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "7221","PubChem_id": "NA","DrugBank_id": "NA"}