Chemical Formula: C17H20O5
Chemical Formula C17H20O5
Found 261 metabolite its formula value is C17H20O5
Angustibalin
Angustibalin is a sesquiterpene lactone. Angustibalin is a natural product found in Arnica longifolia and Arnica montana with data available.
Matricarin
Constituent of Matricaria chamomilla (German chamomile). Matricarin is found in many foods, some of which are herbs and spices, tea, fats and oils, and german camomile. Matricarin is found in fats and oils. Matricarin is a constituent of Matricaria chamomilla (German chamomile)
p-HPEA-EDA
p-HPEA-EDA is the major form of the decarboxymethyl ligstroside-aglycone. p-HPEA-EDA is found in olive. p-HPEA-EDA is found in olive. p-HPEA-EDA is the major form of the decarboxymethyl ligstroside-aglycone
3'-Deoxyoleacein
Constituent of Olea europaea (olive). 3-Deoxyoleacein is found in fats and oils, herbs and spices, and fruits. 3-Deoxyoleacein is found in fats and oils. 3-Deoxyoleacein is a constituent of Olea europaea (olive).
[1aS-(1aalpha,4alpha,4aalpha,5alpha,9aS*)]-5-(Acetyloxy)-1a,2,3,4,4a,5-hexahydro-4,4a,6-trimethyl-9H-oxireno[8,8a]naphtho[2,3-b]furan-9-one
5-[2-(3-Hydroxy-4,5-dimethoxyphenyl)ethyl]-2-methoxyphenol
8alpha-Acetoxy-1beta,10beta-epoxy-3,11(13)-guaiadien-12,6alpha-olide
moscatilin
Dendrophenol is a natural product found in Cymbidium aloifolium, Dendrobium fimbriatum, and other organisms with data available.
[3aS-(3aalpha,7alpha,7abeta,8abeta,8balpha,8cbeta)]-7-(Acetyloxy)-3a,4,5,7,7a,8a,8b,8c-octahydro-6,8a-dimethyl-3-methylene-oxireno[2,3]azuleno[4,5-b]furan-2(3H)-one
2beta-Acetoxy-3alpha,4alpha-epoxy-3,4-dihydrokauniolide
6alpha-acetoxy-1alpha-hydroxyguaia-4(15),10(14),11(13)-trien-8alpha,12-olide
1-Oxo-4??-acetoxyeudesma-2,1(13)-dien-12,8??-olide
1alpha-acetoxy-2-oxo-eudesman-3,7(11)-dien-8beta,12-olide
4,4-(3-Hydroxypropane-1,2-diyl)bis(2-methoxyphenol)
(S)-3,4,4-trihydroxy-5-methoxy-alpha-ethoxybibenzyl|dendrocandin D
4,6-dihydroxy-7-isobutyryl-5-prenyl-2(3H)-benzofuranone
1beta,13,14-trihydroxy-8,11,13-podocarpatriene-2,7-diene
1alpha-acetoxy-2alpha,3alpha-epoxyisoalantolactone|Ac 鈥樎?1alpha,2alpha,3alpha,8beta)-2,3-Epoxy-1-hydroxy-4(15),11(13)-eudesmadien-12,8-olide
8beta-ethoxyeremophil-3,7(11)-diene-8alpha,12(6alpha,15)-diolide
(2S,3R)-3-(p-hydroxyphenyl)-2-(3-hydroxy-4-methoxyphenyl)-3-methoxypropanol|carayensin-B
7-hydroxy-3-[2,3-acetonide-(3-methylbutane)]coumarin|corialin A
(+)-(1R,2S,5R,6R,7R,8S)-8-acetoxy-2-hydroxyguai-3,10(14),11(13)-trien-6,12-olide|argyinolide A
6alpha-acetoxy-10beta-hydroxyguaia-1, 4(15), 11(13)-trien-8alpha,12-olide
5beta-Acetoxy-1-oxogermacra-4(15),10(14),11-trien-12,8alpha-olid
3,2,3-trihydroxy-4,4-dimethoxy-1,3-diphenylpropane
4-[2-(3-Hydroxy-5-methoxyphenyl)ethyl]-2,6-dimethoxyphenol
methyl phenacyl 1,1-dimethylprop-2-enylmalonate|Methyl-phenacyl ester-(1,1-Dimethyl-2-propenyl)propanedioic
(2E,2E)-4-Ac,Me ester-3-[4-Hydroxy-3-(4-hydroxy-3-methyl-2-buteny)phenyl]-2-propenoic acid|methyl 3-(4-hydroxyprenyl)-coumarate 4-O-acetate
1beta-Acetoxy-5-oxogermacra-4(15),10(14),11-trien-12,8alpha-olid
4-[2-(3-hydroxyphenyl)-1-methoxyethyl]-2,6-dimethoxyphenol|longicornuol B
Bigelovin
Bigelovin is a sesquiterpene lactone that is 3,3a,4,4a,7a,8,9,9a-octahydroazuleno[6,5-b]furan-2,5-dione substituted by methyl groups at positions 4a and 8, a methylidene group at position 3 and an acetoxy group at position 4. Isolated from Inula hupehensis, it exhibits antineoplastic activity. It has a role as an apoptosis inducer, an immunomodulator, an antineoplastic agent and a plant metabolite. It is an acetate ester, an organic heterotricyclic compound, a sesquiterpene lactone, a cyclic ketone and a gamma-lactone. Bigelovin is a natural product found in Dittrichia graveolens, Inula hupehensis, and other organisms with data available. A sesquiterpene lactone that is 3,3a,4,4a,7a,8,9,9a-octahydroazuleno[6,5-b]furan-2,5-dione substituted by methyl groups at positions 4a and 8, a methylidene group at position 3 and an acetoxy group at position 4. Isolated from Inula hupehensis, it exhibits antineoplastic activity. Bigelovin, a sesquiterpene lactone isolated from Inula hupehensis, is a selective retinoid X receptor α agonist. Bigelovin suppresses tumor growth through inducing apoptosis and autophagy via the inhibition of mTOR pathway regulated by ROS generation[1].
(1S,8S,9S,10S,13R)-6,9,10-trimethyl-2-oxo-4,14-dioxatetracyclo[7.5.0.0¹,¹³.0³,⁷]tetradeca-3(7),5-dien-8-yl acetate
8-hydroxy-2-oxo-1(10),3-guaiadiene-12,6-olide, Ac
SubCategory_DNP: : Sesquiterpenoids
(1S,8S,9S,10S,13R)-6,9,10-trimethyl-2-oxo-4,14-dioxatetracyclo[7.5.0.0¹,¹³.0³,⁷]tetradeca-3(7),5-dien-8-yl acetate_major
(1S,8S,9S,10S,13R)-6,9,10-trimethyl-2-oxo-4,14-dioxatetracyclo[7.5.0.0¹,¹³.0³,?]tetradeca-3(7),5-dien-8-yl acetate
7α-hydroxy-6β-(3-hydroxy-4-phenoxy-1E-butenyl)-2-oxabicyclo[3.3.0]octan-3-one
2-Methyl-2-propanyl 4-hydroxy-5,7-dimethoxy-2-naphthoate
3,3-[5-(HYDROXYMETHYL)-1,3-PHENYLENE]BIS(2-PROPENOIC ACID) DIETHYL ESTER
methyl (E)-3-(furan-2-yl)-2-[(2-hydroxy-4,4-dimethyl-6-oxocyclohexen-1-yl)methyl]prop-2-enoate
Oleocanthal
A carboxylic ester that is the 2-(p-hydroxyphenyl)ethyl ester of (3S)-4-formyl-3-(2-oxoethyl)hex-4-enoic acid. Oleocanthal is found in olive oil but it is not clear whether the natural product is a mixture of E/Z isomers or a single isomer as the two isomers readily interconvert in solution; most pharmacological studies will have been performed using a mixture.
Dendrocandin D
A diphenylethane that is 1,2-dihydrostilbene substituted by hydroxy groups at positions 3, 4 and 4, a methoxy group at position 5 and an ethoxy group at alpha-position (the S stereoisomer). It is isolated from the stems of Dendrobium candidum and exhibits antioxidant activity.
9-acetoxy-8,10-epoxythymol 3-O-tiglate
A natural product found in Eupatorium cannabinum subspecies asiaticum.
5-Hydroxy-8-(2-hydroxypropan-2-yl)-4-propyl-8,9-dihydrouro[2,3-h]chromen-2-one
2-[2-(3,3-Dimethyloxiran-2-yl)ethyl]-8-hydroxy-2-methylchromene-5-carboxylic acid
4-Hydroxy-2-methyl-2-(4-methylpent-3-enyl)-1a,7b-dihydrooxireno[2,3-c]chromene-7-carboxylic acid
6,8-Dihydroxy-2-methyl-2-(4-methylpent-3-enyl)chromene-5-carboxylic acid
[(3as,11ar)-6-formyl-3-methylidene-2-oxo-3ah,4h,5h,8h,9h,11ah-cyclodeca[b]furan-10-yl]methyl acetate
8-[(1s,2r)-2-ethoxy-1-hydroxy-3-methylbut-3-en-1-yl]-7-methoxychromen-2-one
2-(2-hydroxyethyl)-6-(hydroxymethyl)-4-(3-methoxy-5-methylphenoxy)phenol
[(4ar,8ar,9as)-9a-hydroxy-3,8a-dimethyl-2-oxo-4h,4ah,9h-naphtho[2,3-b]furan-5-yl]methyl acetate
(1s,2r,7s,9s,10r,12s)-7-hydroxy-4,9-dimethyl-13-methylidene-5-oxo-6-oxatetracyclo[7.4.0.0³,⁷.0¹⁰,¹²]tridec-3-en-2-yl acetate
3-methoxy-5-[(1r)-1-methoxy-2-(4-methoxyphenyl)ethyl]benzene-1,2-diol
{6-methyl-3-methylidene-2,9-dioxo-3ah,4h,5h,6h,6ah,9bh-azuleno[4,5-b]furan-9a-yl}methyl acetate
{9a-hydroxy-3,8a-dimethyl-2-oxo-4h,4ah,9h-naphtho[2,3-b]furan-5-yl}methyl acetate
{6-formyl-3-methylidene-2-oxo-3ah,4h,5h,8h,9h,11ah-cyclodeca[b]furan-10-yl}methyl acetate
5-[(1s,2r)-3-hydroxy-1-(4-hydroxyphenyl)-1-methoxypropan-2-yl]-2-methoxyphenol
(1s,2s,7s,9r,10s,12r)-7-hydroxy-4,9-dimethyl-13-methylidene-5-oxo-6-oxatetracyclo[7.4.0.0³,⁷.0¹⁰,¹²]tridec-3-en-2-yl acetate
(4ar,5r,6r,7s)-7-hydroxy-3,4a,5-trimethyl-2-oxo-4h,5h,6h,7h-naphtho[2,3-b]furan-6-yl acetate
6-hydroxy-3,4a,5-trimethyl-2-oxo-4h,5h,6h,7h-naphtho[2,3-b]furan-7-yl acetate
6a-hydroxy-6,9-dimethyl-3-methylidene-2-oxo-3ah,4h,7h,9ah,9bh-azuleno[4,5-b]furan-4-yl acetate
(1r,3s,5s,6r,10s,11r)-3,12-dimethyl-7-methylidene-8-oxo-2,9-dioxatetracyclo[9.3.0.0¹,³.0⁶,¹⁰]tetradec-12-en-5-yl acetate
3,5,8a-trimethyl-2,7-dioxo-4h,4ah,8h,9h,9ah-naphtho[2,3-b]furan-8-yl acetate
(3ar,4s,6s,6as,9ar,9br)-6,9-dimethyl-3-methylidene-2,7-dioxo-3ah,4h,5h,6h,6ah,9ah,9bh-azuleno[4,5-b]furan-4-yl acetate
3-[3-(2-hydroxy-4-methoxyphenyl)propyl]-6-methoxybenzene-1,2-diol
4-[(2s)-2-hydroxy-3-(4-hydroxy-2-methoxyphenyl)propyl]-2-methoxyphenol
{5-methoxy-4-oxo-2-[(1z)-pent-1-en-1-yl]-2,3-dihydro-1-benzopyran-7-yl}acetic acid
8,9-bis(2-hydroxypropan-2-yl)-8h,9h-furo[2,3-h]chromen-2-one
{8-hydroxy-3,9-dimethylidene-2-oxo-3ah,4h,5h,7h,8h,9ah,9bh-azuleno[4,5-b]furan-6-yl}methyl acetate
(3ar,4s,9s,9as,9bs)-9-hydroxy-6,9-dimethyl-3-methylidene-2-oxo-3ah,4h,5h,9ah,9bh-azuleno[4,5-b]furan-4-yl acetate
{1,7-dimethyl-6-oxo-3,5-dioxapentacyclo[8.4.0.0²,⁴.0⁴,⁸.0¹²,¹⁴]tetradec-7-en-11-yl}methyl acetate
(3ar,4r,6ar,8s,9ar,9br)-4-hydroxy-3,6,9-trimethylidene-2-oxo-octahydroazuleno[4,5-b]furan-8-yl acetate
3-methoxy-4-acetoxycinnamyl angelate
{"Ingredient_id": "HBIN008795","Ingredient_name": "3-methoxy-4-acetoxycinnamyl angelate","Alias": "[(E)-3-(4-acetyloxy-3-methoxyphenyl)prop-2-enyl] (Z)-2-methylbut-2-enoate; AC1NSY0P; (Z)-2-Methyl-2-butenoic acid [(E)-3-(4-acetoxy-3-methoxyphenyl)-2-propenyl] ester","Ingredient_formula": "C17H20O5","Ingredient_Smile": "CC=C(C)C(=O)OCC=CC1=CC(=C(C=C1)OC(=O)C)OC","Ingredient_weight": "304.34 g/mol","OB_score": "62.579199","CAS_id": "NA","SymMap_id": "SMIT00843","TCMID_id": "13821","TCMSP_id": "MOL012163","TCM_ID_id": "NA","PubChem_id": "5319394","DrugBank_id": "NA"}
4-hydroxy-1-oxo-2,11(13)-eudesmadien-12,8-olide; (4α,8β)-form,ac
{"Ingredient_id": "HBIN010429","Ingredient_name": "4-hydroxy-1-oxo-2,11(13)-eudesmadien-12,8-olide; (4\u03b1,8\u03b2)-form,ac","Alias": "NA","Ingredient_formula": "C17H20O5","Ingredient_Smile": "NA","Ingredient_weight": "304.34","OB_score": "NA","CAS_id": "144841-05-4","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "7838","PubChem_id": "NA","DrugBank_id": "NA"}
4-hydroxy-1-oxo-2,11(13)-eudesmadien-12,8-olide; (4β,8β)-form,ac
{"Ingredient_id": "HBIN010430","Ingredient_name": "4-hydroxy-1-oxo-2,11(13)-eudesmadien-12,8-olide; (4\u03b2,8\u03b2)-form,ac","Alias": "NA","Ingredient_formula": "C17H20O5","Ingredient_Smile": "NA","Ingredient_weight": "304.34","OB_score": "NA","CAS_id": "144841-04-3","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "7837","PubChem_id": "NA","DrugBank_id": "NA"}
8α-acetoxyarglabin
{"Ingredient_id": "HBIN013618","Ingredient_name": "8\u03b1-acetoxyarglabin","Alias": "NA","Ingredient_formula": "C17H20O5","Ingredient_Smile": "CC1=CCC23C1C4C(C(CC2(O3)C)OC(=O)C)C(=C)C(=O)O4","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "124","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}