Chemical Formula: C18H26O4
Chemical Formula C18H26O4
Found 164 metabolite its formula value is C18H26O4
Capsiate
Capsiate is a carboxylic ester obtained by formal condensation of the carboxy group of (6E)-8-methylnon-6-enoic acid with the benzylic hydroxy group of vanillyl alcohol. A non-pungent analogue of capsaicin with a similar biological profile. It has a role as a plant metabolite, a hypoglycemic agent, an anti-allergic agent, an antioxidant, an angiogenesis inhibitor, an anti-inflammatory agent and a capsaicin receptor agonist. It is a carboxylic ester, a monomethoxybenzene and a member of phenols. It is functionally related to a vanillyl alcohol. Capsiate is a natural product found in Apis cerana with data available. A carboxylic ester obtained by formal condensation of the carboxy group of (6E)-8-methylnon-6-enoic acid with the benzylic hydroxy group of vanillyl alcohol. A non-pungent analogue of capsaicin with a similar biological profile. Constituent of fruits of Capsicum annuum. Capsiate is found in many foods, some of which are orange bell pepper, herbs and spices, yellow bell pepper, and italian sweet red pepper. Capsiate is found in fruits. Capsiate is a constituent of fruits of Capsicum annuum Capsiate, as a capsaicin analogue extracted from a non-pungent cultivar of CH-19 sweet red pepper, is an orally active agonist of TRPV1[1]. Capsiate, as a capsaicin analogue extracted from a non-pungent cultivar of CH-19 sweet red pepper, is an orally active agonist of TRPV1[1].
Dipentyl phthalate
CONFIDENCE standard compound; INTERNAL_ID 613; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 10474; ORIGINAL_PRECURSOR_SCAN_NO 10473 CONFIDENCE standard compound; INTERNAL_ID 613; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 10545; ORIGINAL_PRECURSOR_SCAN_NO 10543 CONFIDENCE standard compound; INTERNAL_ID 613; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 10558; ORIGINAL_PRECURSOR_SCAN_NO 10557 CONFIDENCE standard compound; INTERNAL_ID 613; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 10489; ORIGINAL_PRECURSOR_SCAN_NO 10487 CONFIDENCE standard compound; INTERNAL_ID 613; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 10535; ORIGINAL_PRECURSOR_SCAN_NO 10530 CONFIDENCE standard compound; INTERNAL_ID 613; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 10434; ORIGINAL_PRECURSOR_SCAN_NO 10431 Dipentyl phthalate is an endocrine-disrupting phthalate plasticizer. Dipentyl phthalate increases AMPK phosphorylation and decreases AKT1 phosphorylation and SIRT1 levels. Dipentyl phthalate reduces adrenocorticotropic hormone levels. Dipentyl phthalate is a testicular toxicant[1]. Dipentyl phthalate is an endocrine-disrupting phthalate plasticizer. Dipentyl phthalate increases AMPK phosphorylation and decreases AKT1 phosphorylation and SIRT1 levels. Dipentyl phthalate reduces adrenocorticotropic hormone levels. Dipentyl phthalate is a testicular toxicant[1].
ML 236A
A carbobicyclic compound that is ML-236C substituted by a hydroxy group at position 8S. It is a fungal metabolite isolated from Penicillium citrinum and exhibits anticholesteremic activity.
5-[(2E)-3,7-dimethylocta-2,6-dienyl]-3-methoxy-6-methylbenzene-1,2,4-triol
5'-Carboxy-gamma-chromanol
5-Carboxy-gamma-tocopherol is a dehydrogenation carboxylate product of 5-hydroxy-r-tocopherol by an unidentified microsomal enzyme(s) probably via an aldehyde intermediate. r-Tocopherol provides different antioxidant activities in food and in-vitro studies and showed higher activity in trapping lipophilic electrophiles and reactive nitrogen and oxygen species. From the metabolism end product, only that of r-tocopherol (2,7,8-trimethyl-2-(b-carboxyethyl)-6-hydroxychroman), but not that of a-tocopherol, was identified to provide natriuretic activity. Only the r-tocopherol plasma level served as biomarker for cancer and cardiovascular risk.
(8beta,11E)-form-8,17-Epoxy-15,16-dinor-13-oxo-11-labden-19-oic acid
3beta-angeloyloxy-10beta-hydroxy-8-oxo-eremophil-6(7)-en
(3aS,5R,7aR)-4,4,7a-trimethyl-7a-hydroxymethyl-2-oxo-2,3,3a,4,5,7a-hexahydrobenzo[b]furan-5-yl-3,4-dimethyl-3-pentenoate|3-teracrylmelazolide B
(1S,9R,11S)-14-methoxy-12-acetoxycaryophylla-2(15),5Z-dien-7-one
3-(2,3-dihydroxy-3-methyl-butyl)-5-(3-methyl-2-butenyl)-4-hydroxyacetophenone
(13E,15E)-Chromomoric acid D|(13Z,15E)-Chromomoric acid D
1-(4-hydroxy-3-methoxyphenyl)-5-methoxy-1-decen-3-one|O-methyldehydrogingerol
(R)-7-butyl-6,8-dihydroxy-3-pentylisochroman-1-one
3-geranyl-4-hydroxy-6-(2-hydroxypropyl)-2-pyrone|aurantiacone|geranyl-alpha-pyrone (+/-)-aurantiacone
12-acetoxy-5beta-methoxy-6(14)-dehydro-5,6-dihydrocaryophyllen-7-one
Propanoyl-15-Hydroxy-3,11(13)-eudesmadien-12-oic acid
2-(1beta-geranyl-5beta-hydroxy-2-oxocyclohex-3-enyl)acetic acid|2-(1??-Geranyl-5??-hydroxy-2-oxocyclohex-3-enyl)acetic acid
2-hydroxy-4-methoxy-3-(3-methylbut-2-enyl)-6-pentylbenzoic acid
Latanoprost Lactol
capsiate
Capsiate, as a capsaicin analogue extracted from a non-pungent cultivar of CH-19 sweet red pepper, is an orally active agonist of TRPV1[1]. Capsiate, as a capsaicin analogue extracted from a non-pungent cultivar of CH-19 sweet red pepper, is an orally active agonist of TRPV1[1].
Monoisodecyl phthalate
A phthalic acid monoester obtained by formal condensation of one of the carboxy groups of phthalic acid with the hydroxy group of isodecanol.
(1S,7S,8S,8AR)-1,2,3,7,8,8A-Hexahydro-7-methyl-8-[2-[(2R,4R)-tetrahydro-4-HY droxy-6-oxo-2H-pyran-2-YL]ethyl]-1-naphthalenol
(S)-1-Methyloctyl Caffeate
An alkyl caffeate ester obtained by the formal condensation of trans-caffeic acid with nonan-2-ol. Isolated from the leaves of Piper sanguineispicum, it has been shown to exhibit antileishmanial activity.
(4R,6R)-6-[2-[(1S,2S,8S,8aR)-8-hydroxy-2-methyl-1,2,6,7,8,8a-hexahydronaphthalen-1-yl]ethyl]-4-hydroxy-tetrahydropyran-2-one
6-[4-(5,5-Dimethyltetrahydrofuran-3-yl)phenoxy]hexanoic acid
(2R)-5-[(2R)-6-hydroxy-2,7,8-trimethyl-3,4-dihydro-2H-1-benzopyran-2-yl]-2-methylpentanoic acid
Diamyl phthalate
Dipentyl phthalate is an endocrine-disrupting phthalate plasticizer. Dipentyl phthalate increases AMPK phosphorylation and decreases AKT1 phosphorylation and SIRT1 levels. Dipentyl phthalate reduces adrenocorticotropic hormone levels. Dipentyl phthalate is a testicular toxicant[1]. Dipentyl phthalate is an endocrine-disrupting phthalate plasticizer. Dipentyl phthalate increases AMPK phosphorylation and decreases AKT1 phosphorylation and SIRT1 levels. Dipentyl phthalate reduces adrenocorticotropic hormone levels. Dipentyl phthalate is a testicular toxicant[1].
methyl 2-[7-(acetyloxy)-4a,8-dimethyl-2,3,4,5,6,7-hexahydro-1h-naphthalen-2-yl]prop-2-enoate
[(1s,5e,9r,10s)-6-(methoxymethyl)-10-methyl-2-methylidene-7-oxobicyclo[7.2.0]undec-5-en-10-yl]methyl acetate
[(1s,5r,10s)-5-methoxy-10-methyl-2,6-dimethylidene-7-oxobicyclo[7.2.0]undecan-10-yl]methyl acetate
2-ethenyl-1,8a,10-trihydroxy-8,8-dimethyl-2,3,4,4b,5,6,7,10-octahydro-1h-phenanthren-9-one
(5s)-3-{2-[(1s,4r,6r)-4-hydroxy-1,2,6-trimethylcyclohex-2-en-1-yl]ethyl}-5-(2-oxopropyl)-5h-furan-2-one
methyl (3s,8s,8ar)-3-(acetyloxy)-8-isopropyl-5-methyl-3,4,6,7,8,8a-hexahydronaphthalene-2-carboxylate
(2s)-nonan-2-yl 3-(3,4-dihydroxyphenyl)prop-2-enoate
methyl (1r,2s,5r,8r,9s,11s)-11-(acetyloxy)-2,5,9-trimethyltricyclo[6.3.0.0¹,⁵]undec-3-ene-3-carboxylate
1-[3-(2,3-dihydroxy-3-methylbutyl)-4-hydroxy-5-(3-methylbut-2-en-1-yl)phenyl]ethanone
methyl 2-[(2r,4as,7s)-7-(acetyloxy)-4a,8-dimethyl-2,3,4,5,6,7-hexahydro-1h-naphthalen-2-yl]prop-2-enoate
octyl (2e)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate
5-[(1r,2s,4ar,6r,8r,8as)-1,6-dihydroxy-2,6,8-trimethyl-2,4a,5,7,8,8a-hexahydronaphthalen-1-yl]penta-2,4-dienoic acid
4-hydroxy-6-[2-(8-hydroxy-2-methyl-1,2,6,7,8,8a-hexahydronaphthalen-1-yl)ethyl]oxan-2-one
[(1r,5z,9r,10s)-6-(methoxymethyl)-10-methyl-2-methylidene-7-oxobicyclo[7.2.0]undec-5-en-10-yl]methyl acetate
5-(1,2-dihydroxy-2,6,8-trimethyl-4a,5,6,7,8,8a-hexahydronaphthalen-1-yl)penta-2,4-dienoic acid
3-teracrylmelazolide b
{"Ingredient_id": "HBIN009739","Ingredient_name": "3-teracrylmelazolide b","Alias": "NA","Ingredient_formula": "C18H26O4","Ingredient_Smile": "CC(=C(C)CC(=O)OC1C=CC2(C(C1(C)C)CC(=O)O2)C)C","Ingredient_weight": "306.4 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "20951","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "5321813","DrugBank_id": "NA"}
aurantiacone
{"Ingredient_id": "HBIN017352","Ingredient_name": "aurantiacone","Alias": "NA","Ingredient_formula": "C18H26O4","Ingredient_Smile": "CC(CC1=CC(=C(C(=O)O1)CC=C(C)CCC=C(C)C)O)O","Ingredient_weight": "306.4 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "2007","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "54686940","DrugBank_id": "NA"}