Chemical Formula: C14H22O3
Chemical Formula C14H22O3
Found 135 metabolite its formula value is C14H22O3
3,4-Dimethyl-5-pentyl-2-furanpropanoic acid
3-(3,4-dimethyl-5-pentylfuran-2-yl)propanoic acid
3,4-Dimethyl-5-pentyl-2-furanpropanoic acid is a furan fatty acid (F-acid). F-acids are heterocyclic fatty acids containing a central furan moiety with a carboxylalkyl chain (mostly 7, 9, 11, or 13 carbons) in the 2-position and an alkyl chain (mostly 3 or 5 carbons) in the 5-position. Despite being found in low concentrations in food lipids, they are excellent antixoxidants and radical scavengers. This allows them to play an important role in preventing lipid peroxidation and protecting polyunsaturated fatty acids. They are often incorporated into phospholipids and cholesterol esters of fish and other marine organisms. 3,4-Dimethyl-5-pentyl-2-furanpropanoic acid, in particular, can be described by the shorthand notation 3D5. This refers to its 3-carbon carboxyalkyl moiety, the dimethyl substitutions in the 3- and 4-positions of its furan moiety, and its 5-carbon alkyl moiety. It has been identified in the fish liver.
Geranyl acetoacetate
3,7-Dimethyl-2,6-octadienyl ester(e)-acetoacetic acid
Geranyl acetoacetate is a flavouring ingredient. Flavouring ingredient
(1S,2S)-3-Oxo-2[(2Z)-pentenyl]cyclopentane-1-butyric acid
(1S,2S)-3-Oxo-2[(2Z)-pentenyl]cyclopentane-1-butyric acid
6alpha-acetyl-4beta,5beta-dimethyl-1(10)alpha-epoxy-7beta-hydroxydecalin|laevinol H
6alpha-acetyl-4beta,5beta-dimethyl-1(10)alpha-epoxy-7beta-hydroxydecalin|laevinol H
6alpha-acetyl-4beta,5beta-dimethyl-1(10)-ene-2alpha,7beta-dihydroxydecalin|laevinol C
6alpha-acetyl-4beta,5beta-dimethyl-1(10)-ene-2alpha,7beta-dihydroxydecalin|laevinol C
(6S)-6-Isopropyl-3-methyl-9-oxo-2E,4E-decadiensaeure
(6S)-6-Isopropyl-3-methyl-9-oxo-2E,4E-decadiensaeure
13-hydroxy-rishitin|13-hydroxyrishitin|Rishitin M-1|Rishitin M1|Rislutin-M-1
13-hydroxy-rishitin|13-hydroxyrishitin|Rishitin M-1|Rishitin M1|Rislutin-M-1
4alpha,10beta-dihydroxy-1betaH,5alphaH-guai-6(7)-en-11-one
4alpha,10beta-dihydroxy-1betaH,5alphaH-guai-6(7)-en-11-one
C14H22O3_2-Naphthalenecarboxylic acid, 3,4,4a,5,6,7,8,8a-octahydro-3-hydroxy-5,5,8a-trimethyl
NCGC00381404-01_C14H22O3_2-Naphthalenecarboxylic acid, 3,4,4a,5,6,7,8,8a-octahydro-3-hydroxy-5,5,8a-trimethyl-
3-hydroxy-5,5,8a-trimethyl-3,4,4a,6,7,8-hexahydronaphthalene-2-carboxylic acid
3-hydroxy-5,5,8a-trimethyl-3,4,4a,6,7,8-hexahydronaphthalene-2-carboxylic acid
3-hydroxy-5,5,8a-trimethyl-3,4,4a,6,7,8-hexahydronaphthalene-2-carboxylic acid_major
3-hydroxy-5,5,8a-trimethyl-3,4,4a,6,7,8-hexahydronaphthalene-2-carboxylic acid_major
Geranyl acetoacetate
3,7-Dimethyl-2,6-octadienyl ester(e)-acetoacetic acid
A monoterpenoid that is the carboxylic ester obtained by the formal condensation of geraniol with acetoacetic acid.
(2Z,4E,6S)-6-Isopropyl-3-methyl-9-oxo-2,4-decadienoic acid
(2Z,4E,6S)-6-Isopropyl-3-methyl-9-oxo-2,4-decadienoic acid
(2E,6ξ,7E)-6-Isopropyl-3-methyl-9-oxo-2,4-decadienoic acid
(2E,6ξ,7E)-6-Isopropyl-3-methyl-9-oxo-2,4-decadienoic acid
(2aS,3S,4aR,7aR,7bS)-3-hydroxy-6-(hydroxymethyl)-3,6-dimethyl-1,2,2a,4a,5,7,7a,7b-octahydrocyclobuta[e]inden-4-one
(2aS,3S,4aR,7aR,7bS)-3-hydroxy-6-(hydroxymethyl)-3,6-dimethyl-1,2,2a,4a,5,7,7a,7b-octahydrocyclobuta[e]inden-4-one
anisotanol B
anisotanol B
A norsesquiterpenoid with formula C14H22O3. It is isolated from Anisodus tanguticus.
anisotanol C
anisotanol C
A norsesquiterpenoid with formula C14H22O3. It is isolated from Anisodus tanguticus and displays antiangiogenic activity by inhibiting the viability, migration, and tube formation in HUVECs.
anisotanol D
anisotanol D
A norsesquiterpenoid with formula C14H22O3. It is isolated from Anisodus tanguticus.
(2E,4E,6R,8Z)-6-hydroxytetradeca-2,4,8-trienoic acid
(2E,4E,6R,8Z)-6-hydroxytetradeca-2,4,8-trienoic acid
6,6-Dimethyl-8alpha-(1-oxoethyl)-1alpha,5alpha-bicyclo(3.3.0)octan-2-one ethylene acetal
6,6-Dimethyl-8alpha-(1-oxoethyl)-1alpha,5alpha-bicyclo(3.3.0)octan-2-one ethylene acetal
(2Z)-3,7-dimethylocta-2,6-dien-1-yl 3-oxobutanoate
(2Z)-3,7-dimethylocta-2,6-dien-1-yl 3-oxobutanoate
3-(6-hydroxy-2-methyl-1,2,4a,5,6,7,8,8a-octahydronaphthalen-1-yl)propanoic acid
3-(6-hydroxy-2-methyl-1,2,4a,5,6,7,8,8a-octahydronaphthalen-1-yl)propanoic acid
1-[(1ar,4r,4ar,5s,6s,8as)-6-hydroxy-4,4a-dimethyl-octahydronaphtho[4,4a-b]oxiren-5-yl]ethanone
1-[(1ar,4r,4ar,5s,6s,8as)-6-hydroxy-4,4a-dimethyl-octahydronaphtho[4,4a-b]oxiren-5-yl]ethanone
1-(4,8-dihydroxy-4a,8-dimethyl-1,4,5,6,7,8a-hexahydronaphthalen-2-yl)ethanone
1-(4,8-dihydroxy-4a,8-dimethyl-1,4,5,6,7,8a-hexahydronaphthalen-2-yl)ethanone
1-{6-hydroxy-4,4a-dimethyl-octahydronaphtho[4,4a-b]oxiren-5-yl}ethanone
1-{6-hydroxy-4,4a-dimethyl-octahydronaphtho[4,4a-b]oxiren-5-yl}ethanone
(1r,3s,4s,5r)-5-[(1e,3e,5e)-hepta-1,3,5-trien-1-yl]-4-(hydroxymethyl)cyclohexane-1,3-diol
(1r,3s,4s,5r)-5-[(1e,3e,5e)-hepta-1,3,5-trien-1-yl]-4-(hydroxymethyl)cyclohexane-1,3-diol
4-hydroxy-3-methyl-6-[(5s)-5-methylheptyl]pyran-2-one
4-hydroxy-3-methyl-6-[(5s)-5-methylheptyl]pyran-2-one
(4s,5s,6r)-5,6-dihydroxy-4-isopropyl-6-methyl-2,3,4,5,7,8-hexahydronaphthalen-1-one
(4s,5s,6r)-5,6-dihydroxy-4-isopropyl-6-methyl-2,3,4,5,7,8-hexahydronaphthalen-1-one
(2e,4e,6s)-6-isopropyl-3-methyl-9-oxodeca-2,4-dienoic acid
(2e,4e,6s)-6-isopropyl-3-methyl-9-oxodeca-2,4-dienoic acid
(4S,5S,6R)-5,6-dihydroxy-4-isopropyl-6-methyl-2,3,4,5,7,8-hexahydronaphthalen-1-one
(4S,5S,6R)-5,6-dihydroxy-6-methyl-4-propan-2-yl-2,3,4,5,7,8-hexahydronaphthalen-1-one
{"Ingredient_id": "HBIN010899","Ingredient_name": "(4S,5S,6R)-5,6-dihydroxy-4-isopropyl-6-methyl-2,3,4,5,7,8-hexahydronaphthalen-1-one","Alias": "(4S,5S,6R)-5,6-dihydroxy-6-methyl-4-propan-2-yl-2,3,4,5,7,8-hexahydronaphthalen-1-one","Ingredient_formula": "C14H22O3","Ingredient_Smile": "NA","Ingredient_weight": "238.32","OB_score": "38.51146147","CAS_id": "363610-30-4","SymMap_id": "SMIT10490","TCMID_id": "NA","TCMSP_id": "MOL009347","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
1-(2,6-dihydroxy-8,8a-dimethyl-2,3,4,6,7,8-hexahydro-1h-naphthalen-1-yl)ethanone
1-(2,6-dihydroxy-8,8a-dimethyl-2,3,4,6,7,8-hexahydro-1h-naphthalen-1-yl)ethanone
(3s,5r,7s)-7-hydroxy-3-(hydroxymethyl)-1,1,3,5-tetramethyl-2,5,6,7-tetrahydroinden-4-one
(3s,5r,7s)-7-hydroxy-3-(hydroxymethyl)-1,1,3,5-tetramethyl-2,5,6,7-tetrahydroinden-4-one
3-[(1s,2s,4ar,6s,8as)-6-hydroxy-2-methyl-1,2,4a,5,6,7,8,8a-octahydronaphthalen-1-yl]propanoic acid
3-[(1s,2s,4ar,6s,8as)-6-hydroxy-2-methyl-1,2,4a,5,6,7,8,8a-octahydronaphthalen-1-yl]propanoic acid
(1r,4r,6r,10s,12r)-12-(hydroxymethyl)-4,12-dimethyl-5-oxatricyclo[8.2.0.0⁴,⁶]dodecan-9-one
(1r,4r,6r,10s,12r)-12-(hydroxymethyl)-4,12-dimethyl-5-oxatricyclo[8.2.0.0⁴,⁶]dodecan-9-one
6-hydroxy-7,11,11-trimethyl-12-oxabicyclo[5.4.1]dodec-1-en-3-one
6-hydroxy-7,11,11-trimethyl-12-oxabicyclo[5.4.1]dodec-1-en-3-one
1-(5,7-dihydroxy-8,8a-dimethyl-2,3,5,6,7,8-hexahydro-1h-naphthalen-2-yl)ethanone
1-(5,7-dihydroxy-8,8a-dimethyl-2,3,5,6,7,8-hexahydro-1h-naphthalen-2-yl)ethanone
(4r,5s,6r)-5,6-dihydroxy-4-isopropyl-6-methyl-2,3,4,5,7,8-hexahydronaphthalen-1-one
(4r,5s,6r)-5,6-dihydroxy-4-isopropyl-6-methyl-2,3,4,5,7,8-hexahydronaphthalen-1-one
1-[(2r,5r,7r,8s,8ar)-5,7-dihydroxy-8,8a-dimethyl-2,3,5,6,7,8-hexahydro-1h-naphthalen-2-yl]ethanone
1-[(2r,5r,7r,8s,8ar)-5,7-dihydroxy-8,8a-dimethyl-2,3,5,6,7,8-hexahydro-1h-naphthalen-2-yl]ethanone
5-(hepta-1,3,5-trien-1-yl)-4-(hydroxymethyl)cyclohexane-1,3-diol
5-(hepta-1,3,5-trien-1-yl)-4-(hydroxymethyl)cyclohexane-1,3-diol
4-[(1e)-8-hydroxynon-1-en-1-yl]-3-methyl-5h-furan-2-one
4-[(1e)-8-hydroxynon-1-en-1-yl]-3-methyl-5h-furan-2-one
5,6-dihydroxy-4-isopropyl-6-methyl-2,3,4,5,7,8-hexahydronaphthalen-1-one
5,6-dihydroxy-4-isopropyl-6-methyl-2,3,4,5,7,8-hexahydronaphthalen-1-one
(3r,5r,7r)-7-hydroxy-3-(hydroxymethyl)-1,1,3,5-tetramethyl-2,5,6,7-tetrahydroinden-4-one
(3r,5r,7r)-7-hydroxy-3-(hydroxymethyl)-1,1,3,5-tetramethyl-2,5,6,7-tetrahydroinden-4-one
(1ar,3s,3ar,6as,6br)-3-hydroxy-1a-(hydroxymethyl)-5,5,6b-trimethyl-hexahydrocyclopropa[e]inden-2-one
(1ar,3s,3ar,6as,6br)-3-hydroxy-1a-(hydroxymethyl)-5,5,6b-trimethyl-hexahydrocyclopropa[e]inden-2-one
(2s)-4-[4-(3-hydroxypropyl)phenoxy]-2-methylbutan-1-ol
(2s)-4-[4-(3-hydroxypropyl)phenoxy]-2-methylbutan-1-ol
(1ar,2r,3ar,6as,6br)-2-hydroxy-1a-(hydroxymethyl)-5,5,6b-trimethyl-hexahydrocyclopropa[e]inden-3-one
(1ar,2r,3ar,6as,6br)-2-hydroxy-1a-(hydroxymethyl)-5,5,6b-trimethyl-hexahydrocyclopropa[e]inden-3-one
ethyl 2-[3-oxo-2-(pent-2-en-1-yl)cyclopentyl]acetate
ethyl 2-[3-oxo-2-(pent-2-en-1-yl)cyclopentyl]acetate
(1s,6s,9r,10r)-2,2,6-trimethyl-7,8-dioxatricyclo[7.3.1.0¹,⁶]tridec-4-en-10-ol
(1s,6s,9r,10r)-2,2,6-trimethyl-7,8-dioxatricyclo[7.3.1.0¹,⁶]tridec-4-en-10-ol
2-hydroxy-1a-(hydroxymethyl)-5,5,6b-trimethyl-hexahydrocyclopropa[e]inden-3-one
2-hydroxy-1a-(hydroxymethyl)-5,5,6b-trimethyl-hexahydrocyclopropa[e]inden-3-one
4-[4-oxo-2-(pent-2-en-1-yl)cyclopentyl]butanoic acid
4-[4-oxo-2-(pent-2-en-1-yl)cyclopentyl]butanoic acid
4-[(1e)-7-hydroxynon-1-en-1-yl]-3-methyl-5h-furan-2-one
4-[(1e)-7-hydroxynon-1-en-1-yl]-3-methyl-5h-furan-2-one
1-[(4s,4ar,8s,8ar)-4,8-dihydroxy-4a,8-dimethyl-1,4,5,6,7,8a-hexahydronaphthalen-2-yl]ethanone
1-[(4s,4ar,8s,8ar)-4,8-dihydroxy-4a,8-dimethyl-1,4,5,6,7,8a-hexahydronaphthalen-2-yl]ethanone
4-[3-oxo-2-(pent-2-en-1-yl)cyclopentyl]butanoic acid
4-[3-oxo-2-(pent-2-en-1-yl)cyclopentyl]butanoic acid
(3as,6s,8as)-7-[(3s)-3-hydroxybutyl]-6-methyl-3h,3ah,4h,5h,6h,8ah-cyclohepta[b]furan-2-one
(3as,6s,8as)-7-[(3s)-3-hydroxybutyl]-6-methyl-3h,3ah,4h,5h,6h,8ah-cyclohepta[b]furan-2-one
4-[(1s,2r)-3-oxo-2-[(2z)-pent-2-en-1-yl]cyclopentyl]butanoic acid
4-[(1s,2r)-3-oxo-2-[(2z)-pent-2-en-1-yl]cyclopentyl]butanoic acid
4-hydroxy-3,5-dimethyl-6-(5-methylhexyl)pyran-2-one
4-hydroxy-3,5-dimethyl-6-(5-methylhexyl)pyran-2-one
(1r,3r,5s,6r,10s)-6-hydroxy-5,12,12-trimethyl-4-oxatricyclo[8.2.0.0³,⁵]dodecan-9-one
(1r,3r,5s,6r,10s)-6-hydroxy-5,12,12-trimethyl-4-oxatricyclo[8.2.0.0³,⁵]dodecan-9-one
1-[(1r,2s,6r,8s,8as)-2,6-dihydroxy-8,8a-dimethyl-2,3,4,6,7,8-hexahydro-1h-naphthalen-1-yl]ethanone
1-[(1r,2s,6r,8s,8as)-2,6-dihydroxy-8,8a-dimethyl-2,3,4,6,7,8-hexahydro-1h-naphthalen-1-yl]ethanone
4-[(1s,2s)-3-oxo-2-[(2z)-pent-2-en-1-yl]cyclopentyl]butanoic acid
4-[(1s,2s)-3-oxo-2-[(2z)-pent-2-en-1-yl]cyclopentyl]butanoic acid
1-[(1s)-1,3,3-trimethyl-2-oxocyclohexyl]pentane-1,4-dione
1-[(1s)-1,3,3-trimethyl-2-oxocyclohexyl]pentane-1,4-dione
2,2,6-trimethyl-7,8-dioxatricyclo[7.3.1.0¹,⁶]tridec-4-en-10-ol
2,2,6-trimethyl-7,8-dioxatricyclo[7.3.1.0¹,⁶]tridec-4-en-10-ol
ethyl 2-[(1r,2s)-3-oxo-2-[(2z)-pent-2-en-1-yl]cyclopentyl]acetate
ethyl 2-[(1r,2s)-3-oxo-2-[(2z)-pent-2-en-1-yl]cyclopentyl]acetate
4-(8-hydroxynon-1-en-1-yl)-3-methyl-5h-furan-2-one
4-(8-hydroxynon-1-en-1-yl)-3-methyl-5h-furan-2-one
4-hydroxy-3,5-dimethyl-6-[(2s,4s)-4-methylhexan-2-yl]pyran-2-one
4-hydroxy-3,5-dimethyl-6-[(2s,4s)-4-methylhexan-2-yl]pyran-2-one
(1z)-6-hydroxy-7,11,11-trimethyl-12-oxabicyclo[5.4.1]dodec-1-en-3-one
(1z)-6-hydroxy-7,11,11-trimethyl-12-oxabicyclo[5.4.1]dodec-1-en-3-one
3-(hepta-1,3-dien-1-yl)-5-hydroxy-2-(hydroxymethyl)cyclohexan-1-one
3-(hepta-1,3-dien-1-yl)-5-hydroxy-2-(hydroxymethyl)cyclohexan-1-one
(1r,4r,6r,7s,10s)-7-hydroxy-4,12,12-trimethyl-5-oxatricyclo[8.2.0.0⁴,⁶]dodecan-9-one
(1r,4r,6r,7s,10s)-7-hydroxy-4,12,12-trimethyl-5-oxatricyclo[8.2.0.0⁴,⁶]dodecan-9-one
(1z,6r,7s)-6-hydroxy-7,11,11-trimethyl-12-oxabicyclo[5.4.1]dodec-1-en-3-one
(1z,6r,7s)-6-hydroxy-7,11,11-trimethyl-12-oxabicyclo[5.4.1]dodec-1-en-3-one
1-[(1r,2r,6s,8s,8as)-2,6-dihydroxy-8,8a-dimethyl-2,3,4,6,7,8-hexahydro-1h-naphthalen-1-yl]ethanone
1-[(1r,2r,6s,8s,8as)-2,6-dihydroxy-8,8a-dimethyl-2,3,4,6,7,8-hexahydro-1h-naphthalen-1-yl]ethanone
3-hydroxy-1a-(hydroxymethyl)-5,5,6b-trimethyl-hexahydrocyclopropa[e]inden-2-one
3-hydroxy-1a-(hydroxymethyl)-5,5,6b-trimethyl-hexahydrocyclopropa[e]inden-2-one
(2r,3s,5r)-3-[(1e,3e)-hepta-1,3-dien-1-yl]-5-hydroxy-2-(hydroxymethyl)cyclohexan-1-one
(2r,3s,5r)-3-[(1e,3e)-hepta-1,3-dien-1-yl]-5-hydroxy-2-(hydroxymethyl)cyclohexan-1-one
(1ar,3r,3ar,6as,6br)-3-hydroxy-1a-(hydroxymethyl)-5,5,6b-trimethyl-hexahydrocyclopropa[e]inden-2-one
(1ar,3r,3ar,6as,6br)-3-hydroxy-1a-(hydroxymethyl)-5,5,6b-trimethyl-hexahydrocyclopropa[e]inden-2-one
(2e,4e,8e,13s)-13-hydroxytetradeca-2,4,8-trienoic acid
(2e,4e,8e,13s)-13-hydroxytetradeca-2,4,8-trienoic acid
(4r,5r,6s)-5,6-dihydroxy-4-isopropyl-6-methyl-2,3,4,5,7,8-hexahydronaphthalen-1-one
(4r,5r,6s)-5,6-dihydroxy-4-isopropyl-6-methyl-2,3,4,5,7,8-hexahydronaphthalen-1-one
4-(7-hydroxynon-1-en-1-yl)-3-methyl-5h-furan-2-one
4-(7-hydroxynon-1-en-1-yl)-3-methyl-5h-furan-2-one
1-[(1r,2s,6s,8s,8as)-2,6-dihydroxy-8,8a-dimethyl-2,3,4,6,7,8-hexahydro-1h-naphthalen-1-yl]ethanone
1-[(1r,2s,6s,8s,8as)-2,6-dihydroxy-8,8a-dimethyl-2,3,4,6,7,8-hexahydro-1h-naphthalen-1-yl]ethanone
4-{4-oxo-2-[(2z)-pent-2-en-1-yl]cyclopentyl}butanoic acid
4-{4-oxo-2-[(2z)-pent-2-en-1-yl]cyclopentyl}butanoic acid