NCBI Taxonomy: 262738

Ligularia vellerea (ncbi_taxid: 262738)

found 73 associated metabolites at species taxonomy rank level.

Ancestor: Ligularia

Child Taxonomies: none taxonomy data.

Valencene

NAPHTHALENE, 1,2,3,5,6,7,8,8A-OCTAHYDRO-1,8A-DIMETHYL-7-(1-METHYLETHENYL)-, (1R-(1.ALPHA.,7.BETA.,8A.ALPHA.))-

C15H24 (204.18779039999998)


(+)-valencene is a carbobicyclic compound and sesquiterpene that is 1,2,3,4,4a,5,6,7-octahydronaphthalene which is substituted a prop-1-en-2-yl group at position 3 and by methyl groups at positions 4a and 5 (the 3R,4aS,5R- diastereoisomer). It is a sesquiterpene, a carbobicyclic compound and a polycyclic olefin. Valencene is a natural product found in Xylopia sericea, Helichrysum odoratissimum, and other organisms with data available. Valencene is found in citrus. Valencene is a constituent of orange oil Valencene is a sesquiterpene isolated from Cyperus rotundus, possesses antiallergic, antimelanogenesis, anti-infammatory, and antioxidant activitivies. Valencene inhibits the exaggerated expression of Th2 chemokines and proinflammatory chemokines through blockade of the NF-κB pathway. Valencene is used to flavor foods and drinks[1][2][3].

   

(+)-alpha-Pinene

(R)-(+)--Pinene;(+)--Pinene; (1R)-(+)--Pinene; (1R)--Pinene; (1R,5R)-(+)--Pinene

C10H16 (136.1251936)


alpha-Pinene (CAS: 80-56-8) is an organic compound of the terpene class and is one of two isomers of pinene. It is found in the oils of many species of many coniferous trees, notably the pine. It is also found in the essential oil of rosemary (Rosmarinus officinalis). Both enantiomers are known in nature. 1S,5S- or (-)-alpha-pinene is more common in European pines, whereas the 1R,5R- or (+)-alpha-isomer is more common in North America. The racemic mixture is present in some oils such as eucalyptus oil (Wikipedia). alpha-Pinene is an organic compound of the terpene class, one of two isomers of pinene. It is found in the oils of many species of many coniferous trees, notably the pine. It is also found in the essential oil of rosemary (Rosmarinus officinalis). Both enantiomers are known in nature; 1S,5S- or (-)-alpha-pinene is more common in European pines, whereas the 1R,5R- or (+)-alpha-isomer is more common in North America. The racemic mixture is present in some oils such as eucalyptus oil. (+)-alpha-pinene is the (+)-enantiomer of alpha-pinene. It has a role as a plant metabolite and a human metabolite. It is an enantiomer of a (-)-alpha-pinene. (+)-alpha-Pinene is a natural product found in Juniperus drupacea, Eucalyptus deglupta, and other organisms with data available. The (+)-enantiomer of alpha-pinene. (1R)-α-Pinene is a volatile monoterpene with antimicrobial activities. (1R)-α-Pinene reduces Bacillus cereus population growth, and exhibits repellent effects[1][2]. (1R)-α-Pinene is a volatile monoterpene with antimicrobial activities. (1R)-α-Pinene reduces Bacillus cereus population growth, and exhibits repellent effects[1][2].

   

Pinene

(1R,5R)-2,6,6-Trimethylbicyclo[3.1.1]hept-2-ene

C10H16 (136.1251936)


Pinene (is a bicyclic monoterpene chemical compound. There are two structural isomers of pinene found in nature: alpha-pinene and beta-pinene. As the name suggests, both forms are important constituents of pine resin; they are also found in the resins of many other conifers, as well as in non-coniferous plants. Both isomers are used by many insects in their chemical communication system.

   

Fukinone

(4aR,5S,8aR)-4a,5-dimethyl-3-propan-2-ylidene-4,5,6,7,8,8a-hexahydro-1H-naphthalen-2-one

C15H24O (220.18270539999997)


Constituent of Petasites japonicus (sweet coltsfoot). Fukinone is found in burdock, giant butterbur, and green vegetables. Fukinone is found in burdock. Fukinone is a constituent of Petasites japonicus (sweet coltsfoot)

   

Furanofukinin

4-methoxy-3,4a,5-trimethyl-4H,4aH,5H,6H,7H,8H,8aH,9H-naphtho[2,3-b]furan

C16H24O2 (248.1776204)


Constituent of Petasites japonicus (sweet coltsfoot). Furanofukinin is found in giant butterbur and green vegetables. Furanofukinin is found in giant butterbur. Furanofukinin is a constituent of Petasites japonicus (sweet coltsfoot).

   

Petasalbin

3,4a,5-trimethyl-4H,4aH,5H,6H,7H,8H,8aH,9H-naphtho[2,3-b]furan-4-ol

C15H22O2 (234.1619712)


Constituent of coltsfoot and Petasites japonicus (sweet coltsfoot). Petasalbin is found in tea, giant butterbur, and green vegetables. Petasalbin is found in giant butterbur. Petasalbin is a constituent of coltsfoot and Petasites japonicus (sweet coltsfoot)

   

Ligularol

3,4a,5-trimethyl-4H,4aH,5H,6H,7H,8H,8aH,9H-naphtho[2,3-b]furan-4-ol

C15H22O2 (234.1619712)


   

Fukinone

(4aR,5S,8aR)-4a,5-dimethyl-3-propan-2-ylidene-4,5,6,7,8,8a-hexahydro-1H-naphthalen-2-one

C15H24O (220.18270539999997)


   

Furanofukinin

4-methoxy-3,4a,5-trimethyl-4H,4aH,5H,6H,7H,8H,8aH,9H-naphtho[2,3-b]furan

C16H24O2 (248.1776204)


   

eremophilene

eremophilene

C15H24 (204.18779039999998)


Eremophilene is a member of the class of compounds known as eremophilane, 8,9-secoeremophilane and furoeremophilane sesquiterpenoids. Eremophilane, 8,9-secoeremophilane and furoeremophilane sesquiterpenoids are sesquiterpenoids with a structure based either on the eremophilane skeleton, its 8,9-seco derivative, or the furoeremophilane skeleton. Eremophilanes have been shown to be derived from eudesmanes by migration of the methyl group at C-10 to C-5. Eremophilene can be found in burdock, which makes eremophilene a potential biomarker for the consumption of this food product.

   

80605_FLUKA

Bicyclo(3.1.1)hept-2-ene, 2,6,6-trimethyl-, (1theta)-

C10H16 (136.1251936)


(1R)-α-Pinene is a volatile monoterpene with antimicrobial activities. (1R)-α-Pinene reduces Bacillus cereus population growth, and exhibits repellent effects[1][2]. (1R)-α-Pinene is a volatile monoterpene with antimicrobial activities. (1R)-α-Pinene reduces Bacillus cereus population growth, and exhibits repellent effects[1][2].

   

Valencene

NAPHTHALENE, 1,2,3,5,6,7,8,8A-OCTAHYDRO-1,8A-DIMETHYL-7-(1-METHYLETHENYL)-, (1R-(1.ALPHA.,7.BETA.,8A.ALPHA.))-

C15H24 (204.18779039999998)


(+)-valencene is a carbobicyclic compound and sesquiterpene that is 1,2,3,4,4a,5,6,7-octahydronaphthalene which is substituted a prop-1-en-2-yl group at position 3 and by methyl groups at positions 4a and 5 (the 3R,4aS,5R- diastereoisomer). It is a sesquiterpene, a carbobicyclic compound and a polycyclic olefin. Valencene is a natural product found in Xylopia sericea, Helichrysum odoratissimum, and other organisms with data available. Constituent of orange oil. Valencene is found in many foods, some of which are citrus, common oregano, rosemary, and sweet orange. Valencene is a sesquiterpene isolated from Cyperus rotundus, possesses antiallergic, antimelanogenesis, anti-infammatory, and antioxidant activitivies. Valencene inhibits the exaggerated expression of Th2 chemokines and proinflammatory chemokines through blockade of the NF-κB pathway. Valencene is used to flavor foods and drinks[1][2][3].

   

(1r,8r,12s,15s)-3,15-dimethyl-5,14-dioxatetracyclo[6.6.1.0²,⁶.0¹²,¹⁵]pentadeca-2(6),3-diene

(1r,8r,12s,15s)-3,15-dimethyl-5,14-dioxatetracyclo[6.6.1.0²,⁶.0¹²,¹⁵]pentadeca-2(6),3-diene

C15H20O2 (232.14632200000003)


   

(3s,4s,4as,5s,8ar)-3,4a-dimethyl-4-{[(2z)-2-methylbut-2-enoyl]oxy}-2-oxo-3h,4h,5h,6h,7h,8h,8ah,9h-naphtho[2,3-b]furan-5-carboxylic acid

(3s,4s,4as,5s,8ar)-3,4a-dimethyl-4-{[(2z)-2-methylbut-2-enoyl]oxy}-2-oxo-3h,4h,5h,6h,7h,8h,8ah,9h-naphtho[2,3-b]furan-5-carboxylic acid

C20H26O6 (362.17292960000003)


   

4-ethoxy-3,4a,5-trimethyl-4h,5h,6h,7h,8h,8ah,9h-naphtho[2,3-b]furan

4-ethoxy-3,4a,5-trimethyl-4h,5h,6h,7h,8h,8ah,9h-naphtho[2,3-b]furan

C17H26O2 (262.1932696)


   

3,4a-dimethyl-4-[(2-methylbut-2-enoyl)oxy]-2-oxo-3h,4h,5h,6h,7h,8h,8ah,9h-naphtho[2,3-b]furan-5-carboxylic acid

3,4a-dimethyl-4-[(2-methylbut-2-enoyl)oxy]-2-oxo-3h,4h,5h,6h,7h,8h,8ah,9h-naphtho[2,3-b]furan-5-carboxylic acid

C20H26O6 (362.17292960000003)


   

methyl (2e)-3-(4-{[(2e)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy}phenyl)prop-2-enoate

methyl (2e)-3-(4-{[(2e)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy}phenyl)prop-2-enoate

C19H16O6 (340.0946836)


   

(4s,4ar,5s,8ar)-4-ethoxy-3,4a,5-trimethyl-4h,5h,6h,7h,8h,8ah,9h-naphtho[2,3-b]furan

(4s,4ar,5s,8ar)-4-ethoxy-3,4a,5-trimethyl-4h,5h,6h,7h,8h,8ah,9h-naphtho[2,3-b]furan

C17H26O2 (262.1932696)


   

3,15-dimethyl-5,14-dioxatetracyclo[6.6.1.0²,⁶.0¹²,¹⁵]pentadeca-2(6),3-diene

3,15-dimethyl-5,14-dioxatetracyclo[6.6.1.0²,⁶.0¹²,¹⁵]pentadeca-2(6),3-diene

C15H20O2 (232.14632200000003)


   

1-[(3ar,4s,7ar)-3a,4-dimethyl-1,4,5,6,7,7a-hexahydroinden-2-yl]ethanone

1-[(3ar,4s,7ar)-3a,4-dimethyl-1,4,5,6,7,7a-hexahydroinden-2-yl]ethanone

C13H20O (192.151407)


   

2,5-dihydroxy-6,7-dimethylnaphthalene-1,4-dione

2,5-dihydroxy-6,7-dimethylnaphthalene-1,4-dione

C12H10O4 (218.057906)


   

methyl 3-(4-{[3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy}phenyl)prop-2-enoate

methyl 3-(4-{[3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy}phenyl)prop-2-enoate

C19H16O6 (340.0946836)


   

(1r,6s,8r,12s,15s)-6-hydroxy-3,15-dimethyl-5,14-dioxatetracyclo[6.6.1.0²,⁶.0¹²,¹⁵]pentadec-2-ene-4,13-dione

(1r,6s,8r,12s,15s)-6-hydroxy-3,15-dimethyl-5,14-dioxatetracyclo[6.6.1.0²,⁶.0¹²,¹⁵]pentadec-2-ene-4,13-dione

C15H18O5 (278.1154178)


   

methyl 3,4a-dimethyl-4-[(2-methylbut-2-enoyl)oxy]-4h,5h,6h,7h,8h,8ah,9h-naphtho[2,3-b]furan-5-carboxylate

methyl 3,4a-dimethyl-4-[(2-methylbut-2-enoyl)oxy]-4h,5h,6h,7h,8h,8ah,9h-naphtho[2,3-b]furan-5-carboxylate

C21H28O5 (360.1936638)


   

4-hydroxy-3,4a,5-trimethyl-4h,5h,6h,7h,8h,8ah,9h-naphtho[2,3-b]furan-8-yl 2-methylbut-2-enoate

4-hydroxy-3,4a,5-trimethyl-4h,5h,6h,7h,8h,8ah,9h-naphtho[2,3-b]furan-8-yl 2-methylbut-2-enoate

C20H28O4 (332.19874880000003)


   

3,15-dimethyl-5,14-dioxatetracyclo[6.6.1.0²,⁶.0¹²,¹⁵]pentadeca-2(6),3-dien-13-one

3,15-dimethyl-5,14-dioxatetracyclo[6.6.1.0²,⁶.0¹²,¹⁵]pentadeca-2(6),3-dien-13-one

C15H18O3 (246.1255878)


   

methyl (4s,4as,5s,8ar)-3,4a-dimethyl-4-{[(2z)-2-methylbut-2-enoyl]oxy}-4h,5h,6h,7h,8h,8ah,9h-naphtho[2,3-b]furan-5-carboxylate

methyl (4s,4as,5s,8ar)-3,4a-dimethyl-4-{[(2z)-2-methylbut-2-enoyl]oxy}-4h,5h,6h,7h,8h,8ah,9h-naphtho[2,3-b]furan-5-carboxylate

C21H28O5 (360.1936638)


   

(4s,4ar,5s,8s,8ar)-4-hydroxy-3,4a,5-trimethyl-4h,5h,6h,7h,8h,8ah,9h-naphtho[2,3-b]furan-8-yl (2z)-2-methylbut-2-enoate

(4s,4ar,5s,8s,8ar)-4-hydroxy-3,4a,5-trimethyl-4h,5h,6h,7h,8h,8ah,9h-naphtho[2,3-b]furan-8-yl (2z)-2-methylbut-2-enoate

C20H28O4 (332.19874880000003)


   

(4s,4as,5s,8ar)-3,4a-dimethyl-4-{[(2z)-2-methylbut-2-enoyl]oxy}-4h,5h,6h,7h,8h,8ah,9h-naphtho[2,3-b]furan-5-carboxylic acid

(4s,4as,5s,8ar)-3,4a-dimethyl-4-{[(2z)-2-methylbut-2-enoyl]oxy}-4h,5h,6h,7h,8h,8ah,9h-naphtho[2,3-b]furan-5-carboxylic acid

C20H26O5 (346.17801460000004)


   

1-(3a,4-dimethyl-1,4,5,6,7,7a-hexahydroinden-2-yl)ethanone

1-(3a,4-dimethyl-1,4,5,6,7,7a-hexahydroinden-2-yl)ethanone

C13H20O (192.151407)


   

3,4a-dimethyl-4-[(2-methylbut-2-enoyl)oxy]-4h,5h,6h,7h,8h,8ah,9h-naphtho[2,3-b]furan-5-carboxylic acid

3,4a-dimethyl-4-[(2-methylbut-2-enoyl)oxy]-4h,5h,6h,7h,8h,8ah,9h-naphtho[2,3-b]furan-5-carboxylic acid

C20H26O5 (346.17801460000004)


   

(3r,4s,4as,5s,8ar)-3,4a-dimethyl-4-{[(2z)-2-methylbut-2-enoyl]oxy}-2-oxo-3h,4h,5h,6h,7h,8h,8ah,9h-naphtho[2,3-b]furan-5-carboxylic acid

(3r,4s,4as,5s,8ar)-3,4a-dimethyl-4-{[(2z)-2-methylbut-2-enoyl]oxy}-2-oxo-3h,4h,5h,6h,7h,8h,8ah,9h-naphtho[2,3-b]furan-5-carboxylic acid

C20H26O6 (362.17292960000003)


   

(4s,4ar,5s,8ar)-3,4a,5-trimethyl-4h,5h,6h,7h,8h,8ah,9h-naphtho[2,3-b]furan-4-ol

(4s,4ar,5s,8ar)-3,4a,5-trimethyl-4h,5h,6h,7h,8h,8ah,9h-naphtho[2,3-b]furan-4-ol

C15H22O2 (234.1619712)


   

(1r,8r,12s,15s)-3,15-dimethyl-5,14-dioxatetracyclo[6.6.1.0²,⁶.0¹²,¹⁵]pentadeca-2(6),3-dien-13-one

(1r,8r,12s,15s)-3,15-dimethyl-5,14-dioxatetracyclo[6.6.1.0²,⁶.0¹²,¹⁵]pentadeca-2(6),3-dien-13-one

C15H18O3 (246.1255878)


   

(4s,4ar,5s,8ar)-4-methoxy-3,4a,5-trimethyl-4h,5h,6h,7h,8h,8ah,9h-naphtho[2,3-b]furan

(4s,4ar,5s,8ar)-4-methoxy-3,4a,5-trimethyl-4h,5h,6h,7h,8h,8ah,9h-naphtho[2,3-b]furan

C16H24O2 (248.1776204)


   

6-hydroxy-3,15-dimethyl-5,14-dioxatetracyclo[6.6.1.0²,⁶.0¹²,¹⁵]pentadec-2-ene-4,13-dione

6-hydroxy-3,15-dimethyl-5,14-dioxatetracyclo[6.6.1.0²,⁶.0¹²,¹⁵]pentadec-2-ene-4,13-dione

C15H18O5 (278.1154178)