Zanthoxylum bungeanum
Details Top
| Internal ID | UUID643ffbcf7d900399591839 |
| Scientific name | Zanthoxylum bungeanum |
| Authority | Maxim. |
| First published in | Bull. Acad. Imp. Sci. Saint-Pétersbourg , sér. 3, 16: 212 (1871) |
Ethnobotanical Use Top
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Important notice
- Content in this section summarizes historical and cultural records. It is not medical advice.
- Do not use plants for self-treatment. Safety, efficacy, and appropriate use are not established here.
- Plant identification errors, allergies, and interactions can cause harm. Consult qualified professionals for health questions.
- Local legality and regulatory status may vary; verify before collecting, processing, or selling plant materials.
Zanthoxylum bungeanum, commonly known as Sichuan pepper, has a long history of use in East Asian folk medicine. In traditional Chinese medicine, the dried fruit is brewed as a mild tea to relieve abdominal pain, indigestion, and to stimulate appetite (Li et al., 2018). The bark and leaves are also decocted to treat coughs, sore throats, and to alleviate menstrual cramps (Zhang & Liu, 2015). In Korean traditional practice, a decoction of the fruit and bark is used as a poultice for skin inflammation and as a topical rinse for ear infections (Kim et al., 2020). Vietnamese healers prepare a maceration of the fruit in alcohol to treat fevers and as a mild analgesic for toothaches (Nguyen et al., 2019). Across these cultures, the common theme is the use of infusions or decoctions of the fruit, bark, or leaves to address digestive, respiratory, and inflammatory ailments.
A simple, safe recipe for a Sichuan pepper tea is as follows: combine 5 g of dried fruit with 200 ml of boiling water. Let the mixture steep for 5 minutes, then strain and sip slowly. This preparation delivers a gentle numbing sensation that can soothe an upset stomach or relieve mild pain. The tea is generally well tolerated, but it should be avoided by pregnant women and individuals with a history of gastrointestinal sensitivity, as high doses of the alkylamides can cause mild nausea or abdominal discomfort.
The therapeutic effects of Zanthoxylum bungeanum are largely attributed to its alkylamides, particularly sanshools (α‑sanshool, β‑sanshool), which are responsible for the characteristic tingling and analgesic properties. The plant also contains flavonoids such as quercetin and kaempferol, as well as essential oils rich in monoterpenes and sesquiterpenes that contribute to its anti‑inflammatory and antimicrobial activities. These constituents have been isolated and quantified in several phytochemical studies, providing a clear biochemical basis for the traditional uses described above.
Today, Sichuan pepper remains a staple spice in Chinese cuisine, prized for its unique citrusy flavor and numbing effect. Ongoing research is exploring its potential as a natural analgesic and anti‑inflammatory agent, and commercial extracts are available for both culinary and therapeutic purposes.
General Uses Top
Suggest a correction!Common products:
- Dried fruit (Sichuan peppercorn) used as a spice in Chinese cuisine, sauces, pickles, and processed foods.
- Essential oil extracted from the fruit used as a flavoring additive in food products and beverages.
- Cultivated ornamental tree grown for landscaping and garden use.
Industrial and craft applications:
- Ornamental horticulture: trees are planted in parks, gardens, and urban landscapes for their attractive foliage and fruit.
- The fruit is processed into dried peppercorns, pepper powders, and Sichuan pepper oil, which are sold to food manufacturers and retailers.
Food and beverages (non‑medicinal):
- Dried peppercorns are a key ingredient in Sichuan cuisine, added to stir‑fries, sauces, and spice blends.
- The fruit is used to produce Sichuan pepper paste, oil, and vinegar, which are incorporated into sauces, marinades, and pickled products.
- Essential oil is added to beverages such as tea, coffee, and soft drinks, and to confectionery for a distinctive numbing flavor.
Fragrance and cosmetics:
- The essential oil of Zanthoxylum bungeanum is used as a fragrance ingredient in perfumes, soaps, lotions, and other cosmetic formulations.
Properties relevant to use:
- Fruit contains 0.5–1.5 % essential oil rich in monoterpenes (limonene, linalool) and sesquiterpenes, providing aroma and flavor.
- Piperidine alkaloids in the fruit give the characteristic numbing sensation and contribute to flavor profile.
- High pectin content facilitates use as a gelling agent in food processing.
- The oil yield and composition make the fruit suitable for flavoring and fragrance applications.
Standards and regulation:
- Food flavoring ingredients are regulated under FDA Food Additives and EU Food Safety Authority (EFSA) guidelines.
- Cosmetic fragrance ingredients are subject to EU Regulation (EC) No 1223/2009 and US FDA Cosmetic Product Safety regulations.
Sustainability and sourcing:
- Zanthoxylum bungeanum is cultivated primarily in Sichuan Province, China, and other regions; fruit is harvested from managed orchards.
- Sustainable cultivation practices are reported; the species is not listed as threatened.
- Essential oil extraction typically uses steam distillation or solvent extraction; by‑products are used as animal feed or compost, supporting circular use of plant material.
Synonyms Top
| Scientific name | Authority | First published in |
|---|---|---|
| Zanthoxylum nitidum | Bunge | Enum. Pl. China Bor. [A.A. von Bunge] 13. 1833 [Mar 1833] |
| Zanthoxylum nepalense | Babu | Bull. Bot. Surv. India 16: 60 (1974 publ. 1977) |
| Zanthoxylum piperitum | Benn. | Ann. Mag. Nat. Hist. ser. 3, 10: 200. 1862 |
| Zanthoxylum usitatum | Diels | Notes Roy. Bot. Gard. Edinburgh 5: 280. 1912 |
| Zanthoxylum fraxinoides | Hemsl. | in Ann. Bot. ix. (1895) 148. |
| Zanthoxylum bungei | Planch. | Ann. Sci. Nat., Bot. , sér. 3, 19: 82 (1853) |
| Zanthoxylum ovalifoliolatum | Nakai | Bot. Mag. (Tokyo) 44: 527 (1930) |
| Fagara bungei | (Planch.) M.Hiroe | Forest Pl. Hist. Jap. Islands 1: 185 (1974) |
| Fagara piperita | L. | Syst. Nat. ed. 10 , 2: 897 (1759) |
| Zanthoxylum bungei var. imperforatum | Franch. | Mém. Soc. Sci. Nat. Cherbourg 24: 205 1884 |
| Zanthoxylum simulans var. imperforatum | (Franch.) Reeder & S.Y.Cheo | J. Arnold Arbor. 32: 70 1951 |
| Zanthoxylum bungei | Planch. & Linden ex Hance | J. Bot. 13: 131 1875 |
| Zanthoxylum bungei var. inermis | Franch. | Pl. David. 1: 67 1884 |
| Zanthoxylum simulans var. podocarpum | (Hemsl.) C.C.Huang | Acta Phytotax. Sin. 6(1): 20 1957 |
| Zanthoxylum piperitum var. hispidum | (Hayashi) Konta | Bull. Natl. Sci. Mus. Tokyo, B 31: 20 (2005) |
| Zanthoxylum piperitum var. spinosum | Konta | Bull. Natl. Sci. Mus. Tokyo, B 32: 36 (2006) |
Common names Top
Add a new one! Suggest a correction!| Language | Common/alternative name |
|---|---|
| Arabic | فاغرة فلفلية |
| Bulgarian | японски пипер |
| Japanese | 花椒 |
| Japanese | カホクザンショウ |
| mnc | ᡶᡠᠰᡝᡵᡳ |
| ug | كاۋاۋىچىن |
| Ukrainian | Перець японський |
| Chinese | 花椒 |
| Chinese | 入山虎 |
| Chinese | 椒目 |
| Chinese | 花椒叶 |
| Chinese | 花椒根 |
| Chinese | 花椒茎 |
| Chinese | 簕欓 |
| Chinese | 钉板刺 |
| Chinese | 麻药藤 |
Varieties (abbr. var.) Top
Add a new one! Suggest a correction!| Name | Authority | First published in |
|---|---|---|
| Zanthoxylum bungeanum var. bungeanum | ||
| Zanthoxylum bungeanum var. pubescens | C.C.Huang | Acta Phytotax. Sin. 6: 24 (1957) |
| Zanthoxylum bungeanum var. punctatum | C.C.Huang | Acta Phytotax. Sin. 16(2): 81. 1978 |
Germination/Propagation Top
Suggest a correction or add new data!
No germination or propagation data was added yet.
Distribution (via POWO/KEW) Top
Legend for the distribution data:
- Doubtful data
- Extinct
- Introduced
- Native
-
Asia-temperate click to expand
-
China
- China North-central
- China South-central
- China Southeast
- Inner Mongolia
- Manchuria
- Qinghai
- Tibet
- Xinjiang
-
Middle Asia
- Uzbekistan
-
China
-
Asia-tropical click to expand
-
Indian Subcontinent
- East Himalaya
- Nepal
-
Indian Subcontinent
Links to other databases Top
Suggest others/fix!| Database | ID/link to page |
|---|---|
| World Flora Online | wfo-0000429522 |
| UNII | WH9894JM8K |
| Tropicos | 50054098 |
| KEW | urn:lsid:ipni.org:names:775625-1 |
| The Plant List | kew-2469335 |
| PFAF | Zanthoxylum bungeanum |
| Open Tree Of Life | 889918 |
| Observations.org | 368405 |
| NCBI Taxonomy | 328401 |
| IUCN Red List | 150282557 |
| IPNI | 775625-1 |
| iNaturalist | 506467 |
| GBIF | 7269010 |
| EPPO | ZANSI |
| EOL | 2888549 |
| Elurikkus | 580762 |
| USDA GRIN | 413306 |
| Wikipedia | Zanthoxylum_bungeanum |
| CMAUP | NPO5315 |
Genomes (via NCBI) Top
Below is displayed the reference genome only!
If you wish to browse all genomes for this plant click here.
If you wish to browse all genomes for this plant click here.
| Accession | Assembly | |||||
|---|---|---|---|---|---|---|
| Name | Level | Submitter | Released | Coverage | Size | |
| GCA_051990225.1 | ASM5199022v1 | Scaffold | Southwest University | 2025-08-13 | 100 | 3.71 Gb |
Scientific Literature Top
Below are displayed the latest 15 articles published in PMC (PubMed Central®) and other sources (DOI number only)!
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If you wish to see all the related articles click here.
Phytochemical Profile Top
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Below are displayed the proven (via scientific papers) natural compounds!
You can also contribute to this by clicking here.
You can also contribute to this by clicking here.
| Name | PubChem ID | Canonical SMILES | MW | Found in | Proof |
|---|---|---|---|---|---|
| > Alkaloids and derivatives / Aporphines | |||||
| 1-((7aR)-5,6,7a,8-Tetrahydro-7H-benzo(g)-1,3-benzodioxolo(6,5,4-de)quinolin-7-yl)ethanone | 6453733 | Click to see | 307.30 | unknown | via CMAUP database |
| > Alkaloids and derivatives / Benzophenanthridine alkaloids / Dihydrobenzophenanthridine alkaloids | |||||
| Dihydrochelerythrine | 485077 | Click to see | 349.40 | unknown | via CMAUP database |
| > Alkaloids and derivatives / Benzophenanthridine alkaloids / Quaternary benzophenanthridine alkaloids | |||||
| (1,3)Benzodioxolo(5,6-c)phenanthridinium, 1,2-dimethoxy-12-methyl-, hydroxide (1:1) | 5351594 | Click to see | 365.40 | unknown | via CMAUP database |
| Chelerythrine | 2703 | Click to see | 348.40 | unknown | via CMAUP database |
| > Alkaloids and derivatives / Benzophenanthridine alkaloids / Secobenzophenanthridine alkaloids | |||||
| Arnottianamide | 3085181 | Click to see CN(C=O)C1=C(C=CC2=CC3=C(C=C21)OCO3)C4=C(C(=C(C=C4)OC)OC)O | 381.40 | unknown | via CMAUP database |
| > Alkaloids and derivatives / Protoberberine alkaloids and derivatives | |||||
| 16,17-Dimethoxy-6-tritio-5,7-dioxa-13-azoniapentacyclo[11.8.0.02,10.04,8.015,20]henicosa-1(13),2,4(8),9,14,16,18,20-octaene | 10246509 | Click to see | 338.40 | unknown | via CMAUP database |
| > Benzenoids / Benzene and substituted derivatives | |||||
| 2-Phenylethyl Acetate | 7654 | Click to see | 164.20 | unknown | via CMAUP database |
| Ethyl phenylacetate | 7590 | Click to see | 164.20 | unknown | via CMAUP database |
| Methyl phenylacetate | 7559 | Click to see | 150.17 | unknown | via CMAUP database |
| > Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Methoxybenzoic acids and derivatives / P-methoxybenzoic acids and derivatives | |||||
| Isovanillic Acid | 12575 | Click to see | 168.15 | unknown | https://doi.org/10.1002/PTR.2650070111 |
| > Benzenoids / Benzene and substituted derivatives / Cumenes | |||||
| o-Cymene | 10703 | Click to see CC1=CC=CC=C1C(C)C | 134.22 | unknown | via CMAUP database |
| > Benzenoids / Benzene and substituted derivatives / Halobenzenes / Fluorobenzenes | |||||
| 4-Fluoro-alpha-propylbenzenemethanol | 102471 | Click to see | 168.21 | unknown | via CMAUP database |
| > Benzenoids / Benzene and substituted derivatives / Methoxybenzenes / Dimethoxybenzenes | |||||
| Methyleugenol | 7127 | Click to see COC1=C(C=C(C=C1)CC=C)OC | 178.23 | unknown | via CMAUP database |
| > Benzenoids / Benzene and substituted derivatives / Phenylpropanes | |||||
| (R)-2-methyl-3-phenylpropanal | 1549658 | Click to see CC(CC1=CC=CC=C1)C=O | 148.20 | unknown | via CMAUP database |
| 2-(4-Methylphenyl)propan-2-ol | 14529 | Click to see CC1=CC=C(C=C1)C(C)(C)O | 150.22 | unknown | via CMAUP database |
| 2-Methyl-3-phenylpropionaldehyde | 95593 | Click to see | 148.20 | unknown | via CMAUP database |
| 2-Phenyl-2-propanol | 12053 | Click to see CC(C)(C1=CC=CC=C1)O | 136.19 | unknown | https://doi.org/10.1055/S-2006-960033 |
| > Benzenoids / Benzene and substituted derivatives / Phenylpropenes | |||||
| p-alpha-Dimethyl styrene | 62385 | Click to see | 132.20 | unknown | via CMAUP database |
| > Benzenoids / Benzene and substituted derivatives / Toluenes | |||||
| Toluene | 1140 | Click to see | 92.14 | unknown | via CMAUP database |
| > Benzenoids / Phenol ethers | |||||
| 1H-1,2,4-Triazole-1-ethanol, alpha-(1,1-dimethylethyl)-beta-(2-phenoxyethyl)- | 157664 | Click to see | 289.37 | unknown | via CMAUP database |
| > Benzenoids / Phenol ethers / Anisoles | |||||
| Anethole | 637563 | Click to see | 148.20 | unknown | via CMAUP database |
| Anethole, (Z)- | 1549040 | Click to see CC=CC1=CC=C(C=C1)OC | 148.20 | unknown | via CMAUP database |
| Estragole | 8815 | Click to see | 148.20 | unknown | via CMAUP database |
| > Benzenoids / Phenols / Methoxyphenols | |||||
| Eugenol | 3314 | Click to see | 164.20 | unknown | via CMAUP database |
| > Hydrocarbons / Saturated hydrocarbons / Alkanes | |||||
| Decane | 15600 | Click to see | 142.28 | unknown | via CMAUP database |
| Hexadecane | 11006 | Click to see CCCCCCCCCCCCCCCC | 226.44 | unknown | via CMAUP database |
| Octadecane | 11635 | Click to see CCCCCCCCCCCCCCCCCC | 254.50 | unknown | via CMAUP database |
| Pentadecane | 12391 | Click to see | 212.41 | unknown | via CMAUP database |
| Tetradecane | 12389 | Click to see | 198.39 | unknown | via CMAUP database |
| > Hydrocarbons / Saturated hydrocarbons / Alkanes / Branched alkanes | |||||
| 3-Methylpentadecane | 17899 | Click to see | 226.44 | unknown | via CMAUP database |
| > Hydrocarbons / Unsaturated hydrocarbons / Branched unsaturated hydrocarbons | |||||
| Cyclohexene, 1,5,5-trimethyl-6-methylene- | 578237 | Click to see | 136.23 | unknown | via CMAUP database |
| Gamma-Terpinene | 7461 | Click to see | 136.23 | unknown | via CMAUP database |
| > Hydrocarbons / Unsaturated hydrocarbons / Olefins / Acyclic olefins / Alkatrienes | |||||
| (E,E,E)-2,4,6-Octatriene | 5368766 | Click to see | 108.18 | unknown | via CMAUP database |
| 1,3,7-Octatriene | 5365557 | Click to see C=CCCC=CC=C | 108.18 | unknown | via CMAUP database |
| Octa-1,3,7-triene | 101945 | Click to see | 108.18 | unknown | via CMAUP database |
| > Lignans, neolignans and related compounds / Furanoid lignans | |||||
| 4-[(3R,3aS,6R,6aS)-3-(1,3-benzodioxol-5-yl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-6-yl]-2-methoxyphenol | 70695728 | Click to see | 356.40 | unknown | via CMAUP database |
| Piperitol | 10247670 | Click to see | 356.40 | unknown | via CMAUP database |
| Sesamin, (-)- | 382073 | Click to see | 354.40 | unknown | https://doi.org/10.1016/0031-9422(94)00965-V |
| > Lipids and lipid-like molecules / Fatty Acyls / Fatty acid esters | |||||
| (2-Pentadecyl-1,3-dioxolan-4-yl)methyl palmitate | 631084 | Click to see | 552.90 | unknown | via CMAUP database |
| Butyl butyrate | 7983 | Click to see | 144.21 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Fatty Acyls / Fatty acid esters / Fatty acid methyl esters | |||||
| Methyl 4-methylpentanoate | 17008 | Click to see CC(C)CCC(=O)OC | 130.18 | unknown | via CMAUP database |
| Methyl Palmitate | 8181 | Click to see | 270.50 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Fatty Acyls / Fatty acids and conjugates / Branched fatty acids / Methyl-branched fatty acids | |||||
| 4-Methylpentanoate | 4275592 | Click to see CC(C)CCC(=O)[O-] | 115.15 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Fatty Acyls / Fatty acids and conjugates / Long-chain fatty acids | |||||
| Elaidic Acid | 637517 | Click to see CCCCCCCCC=CCCCCCCCC(=O)O | 282.50 | unknown | via CMAUP database |
| Oleic Acid | 445639 | Click to see | 282.50 | unknown | via CMAUP database |
| Oleic acid-d2 | 13011408 | Click to see CCCCCCCCC=CCCCCCCCC(=O)O | 284.50 | unknown | via CMAUP database |
| Palmitic Acid | 985 | Click to see | 256.42 | unknown | https://doi.org/10.1016/0031-9422(94)00965-V |
| > Lipids and lipid-like molecules / Fatty Acyls / Fatty alcohol esters | |||||
| Citronellyl acetate | 9017 | Click to see CC(CCC=C(C)C)CCOC(=O)C | 198.30 | unknown | via CMAUP database |
| Geranyl acetate | 1549026 | Click to see CC(=CCCC(=CCOC(=O)C)C)C | 196.29 | unknown | via CMAUP database |
| Neryl acetate | 1549025 | Click to see | 196.29 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Fatty Acyls / Fatty alcohols | |||||
| (R)-4-Methyl-1-heptanol | 13800371 | Click to see | 130.23 | unknown | via CMAUP database |
| 1-Heptanol, 2,4-diethyl- | 549992 | Click to see | 172.31 | unknown | via CMAUP database |
| 1-Hexanol | 8103 | Click to see CCCCCCO | 102.17 | unknown | via CMAUP database |
| 2,6-Dimethylocta-1,7-diene-3,6-diol | 548927 | Click to see CC(=C)C(CCC(C)(C=C)O)O | 170.25 | unknown | via CMAUP database |
| 4-Methyl-1-heptanol | 109451 | Click to see | 130.23 | unknown | via CMAUP database |
| 6-Methyl-1-heptanol | 15450 | Click to see CC(C)CCCCCO | 130.23 | unknown | via CMAUP database |
| Heptanol | 8129 | Click to see | 116.20 | unknown | via CMAUP database |
| Nonan-1-ol | 8914 | Click to see CCCCCCCCCO | 144.25 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Fatty Acyls / Fatty amides / N-acyl amines | |||||
| (2E,4E,8E)-N-(2-hydroxy-2-methylpropyl)tetradeca-2,4,8-trienamide | 101936592 | Click to see | 293.40 | unknown | https://doi.org/10.1016/S0031-9422(97)84398-1 |
| (2E,4E,8Z,10E,12E)-N-(2-hydroxypropan-2-yl)tetradeca-2,4,8,10,12-pentaenamide | 5318129 | Click to see | 275.40 | unknown |
https://doi.org/10.1248/CPB.36.2362 https://doi.org/10.1016/S0031-9422(97)84398-1 |
| (2E,4E,8Z,10E,12E)-N-(2-methylprop-2-enyl)tetradeca-2,4,8,10,12-pentaenamide | 5316465 | Click to see CC=CC=CC=CCCC=CC=CC(=O)NCC(=C)C | 271.40 | unknown | https://doi.org/10.1016/S0031-9422(97)84398-1 |
| (2E,4E,8Z,10E,12E)-N-propan-2-yltetradeca-2,4,8,10,12-pentaenamide | 5321102 | Click to see CC=CC=CC=CCCC=CC=CC(=O)NC(C)C | 259.40 | unknown | https://doi.org/10.1016/S0031-9422(97)84398-1 |
| (2E,4E,8Z,11E)-N-(2-hydroxy-2-methylpropyl)tetradeca-2,4,8,11-tetraenamide | 14135320 | Click to see CCC=CCC=CCCC=CC=CC(=O)NCC(C)(C)O | 291.40 | unknown |
https://doi.org/10.1016/S0031-9422(99)00175-2 https://doi.org/10.1248/CPB.36.2362 https://doi.org/10.1016/S0031-9422(97)84398-1 |
| (2E,4E,8Z)-N-(2-hydroxy-2-methylpropyl)tetradeca-2,4,8-trienamide | 5316694 | Click to see | 293.40 | unknown |
https://doi.org/10.1021/JF0481857 https://doi.org/10.1016/S0031-9422(97)84398-1 |
| (2E,6E,8E)-10-hydroxy-N-(2-hydroxy-2-methylpropyl)-5-oxoundeca-2,6,8-trienamide | 127025457 | Click to see CC(C=CC=CC(=O)CC=CC(=O)NCC(C)(C)O)O | 281.35 | unknown | https://doi.org/10.1016/J.BMCL.2015.12.015 |
| (2E,6R,7E,9E)-6-hydroxy-N-(2-hydroxy-2-methylpropyl)-11-oxododeca-2,7,9-trienamide | 101357058 | Click to see | 295.37 | unknown | via CMAUP database |
| (2E,6Z,8E,10Z)-N-(2-hydroxy-2-methylpropyl)dodeca-2,6,8,10-tetraenamide | 46870578 | Click to see CC=CC=CC=CCCC=CC(=O)NCC(C)(C)O | 263.37 | unknown | https://doi.org/10.1007/S12272-001-1194-5 |
| (2E,7E,9E)-11-ethoxy-6-hydroxy-N-(2-hydroxy-2-methylpropyl)dodeca-2,7,9-trienamide | 127025456 | Click to see | 325.40 | unknown | https://doi.org/10.1016/J.BMCL.2015.12.015 |
| (2E,7E,9E)-6-ethoxy-11-hydroxy-N-(2-hydroxy-2-methylpropyl)dodeca-2,7,9-trienamide | 127025455 | Click to see CCOC(CCC=CC(=O)NCC(C)(C)O)C=CC=CC(C)O | 325.40 | unknown | https://doi.org/10.1016/J.BMCL.2015.12.015 |
| (2E,7E,9E)-6,11-dihydroxy-N-(2-hydroxy-2-methylpropyl)dodeca-2,7,9-trienamide | 71720071 | Click to see CC(C=CC=CC(CCC=CC(=O)NCC(C)(C)O)O)O | 297.39 | unknown | https://doi.org/10.1016/J.BMCL.2015.12.015 |
| Bungeanool | 14135319 | Click to see | 291.40 | unknown |
https://doi.org/10.1248/CPB.36.2362 https://doi.org/10.1016/S0031-9422(97)84398-1 |
| Hydroxy alpha sanshool | 53429684 | Click to see | 263.37 | unknown |
https://doi.org/10.1248/CPB.36.2362 https://doi.org/10.1016/S0031-9422(97)84398-1 |
| Hydroxy-alpha-sanshool | 10084135 | Click to see CC=CC=CC=CCCC=CC(=O)NCC(C)(C)O | 263.37 | unknown |
https://doi.org/10.1007/S12272-001-1194-5 https://doi.org/10.1271/BBB.69.1951 https://doi.org/10.1016/0031-9422(82)80128-3 https://doi.org/10.1248/CPB.36.2362 |
| Hydroxy-Beta-Sanshool | 10220912 | Click to see | 263.37 | unknown |
https://doi.org/10.1248/CPB.36.2362 https://doi.org/10.1016/S0031-9422(97)84398-1 https://doi.org/10.1271/BBB.69.1951 https://doi.org/10.1002/PTR.2650070111 https://doi.org/10.1007/S12272-001-1194-5 |
| Hydroxy-Gamma-Isosanshool | 14135316 | Click to see | 289.40 | unknown |
https://doi.org/10.1016/S0031-9422(96)00683-8 https://doi.org/10.1248/CPB.36.2362 https://doi.org/10.1016/S0031-9422(97)84398-1 |
| Hydroxy-Gamma-Sanshool | 14135317 | Click to see | 289.40 | unknown | https://doi.org/10.1248/CPB.36.2362 |
| N-(2-hydroxy-2-methylpropyl)tetradeca-2,4,8,11-tetraenamide | 53893658 | Click to see CCC=CCC=CCCC=CC=CC(=O)NCC(C)(C)O | 291.40 | unknown | https://doi.org/10.1248/CPB.36.2362 |
| Tetrahydrobungeanool | 5321844 | Click to see | 295.50 | unknown |
https://doi.org/10.1016/S0031-9422(97)84398-1 https://doi.org/10.1016/S0031-9422(99)00175-2 |
| ZP-amide C | 9839194 | Click to see | 297.39 | unknown | https://doi.org/10.1016/J.BMCL.2015.12.015 |
| > Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Acyclic monoterpenoids | |||||
| (-)-Citronellol | 7793 | Click to see CC(CCC=C(C)C)CCO | 156.26 | unknown | via CMAUP database |
| (+)-Linalyl acetate | 6999980 | Click to see | 196.29 | unknown | via CMAUP database |
| (R)-(+)-Citronellal | 75427 | Click to see CC(CCC=C(C)C)CC=O | 154.25 | unknown | via CMAUP database |
| (S)-(-)-Citronellal | 443157 | Click to see | 154.25 | unknown | via CMAUP database |
| 2-Ethenyl-2,6-dimethylhept-5-enoate | 17998685 | Click to see | 181.25 | unknown | via CMAUP database |
| 2,6-Dimethyl-2,4,6-octatriene | 5368821 | Click to see CC=C(C)C=CC=C(C)C | 136.23 | unknown | via CMAUP database |
| 5,9-Dimethyldec-8-enoate | 21612892 | Click to see CC(CCCC(=O)[O-])CCC=C(C)C | 197.29 | unknown | via CMAUP database |
| Alloocimene, (4E,6Z)- | 5371125 | Click to see | 136.23 | unknown | via CMAUP database |
| beta-CITRONELLOL, (R)- | 101977 | Click to see | 156.26 | unknown | via CMAUP database |
| beta-Ocimene | 18756 | Click to see CC(=CCC=C(C)C=C)C | 136.23 | unknown | via CMAUP database |
| beta-OCIMENE, (3E)- | 5281553 | Click to see | 136.23 | unknown | https://doi.org/10.1055/S-2006-960033 |
| beta-Ocimene, (3Z)- | 5320250 | Click to see | 136.23 | unknown | https://doi.org/10.1055/S-2006-960033 |
| cis-alpha-Ocimene | 5463455 | Click to see | 136.23 | unknown | via CMAUP database |
| Citral | 638011 | Click to see | 152.23 | unknown | via CMAUP database |
| Citronellal | 7794 | Click to see | 154.25 | unknown | https://doi.org/10.1055/S-2006-960033 |
| Citronellol | 8842 | Click to see | 156.26 | unknown | via CMAUP database |
| Geraniol | 637566 | Click to see CC(=CCCC(=CCO)C)C | 154.25 | unknown | via CMAUP database |
| Linalool | 6549 | Click to see | 154.25 | unknown |
https://doi.org/10.1021/NP50096A019 https://doi.org/10.1055/S-2006-960033 |
| Linalool formate | 61040 | Click to see | 182.26 | unknown | via CMAUP database |
| Linalool, (-)- | 443158 | Click to see CC(=CCCC(C)(C=C)O)C | 154.25 | unknown | via CMAUP database |
| Linalool, (+)- | 67179 | Click to see | 154.25 | unknown | via CMAUP database |
| Linalyl Acetate | 8294 | Click to see | 196.29 | unknown | via CMAUP database |
| Linalyl acetate, (-)- | 442474 | Click to see | 196.29 | unknown | via CMAUP database |
| Linalyl propionate | 61098 | Click to see | 210.31 | unknown | via CMAUP database |
| Methyl (3R)-3,7-dimethyloct-6-enoate | 10976170 | Click to see | 184.27 | unknown | via CMAUP database |
| Methyl (3S)-3,7-dimethyloct-6-enoate | 11745305 | Click to see | 184.27 | unknown | via CMAUP database |
| Methyl rhodinolate | 61290 | Click to see | 184.27 | unknown | via CMAUP database |
| Myrcene | 31253 | Click to see | 136.23 | unknown | https://doi.org/10.1055/S-2006-960033 |
| Nerol | 643820 | Click to see CC(=CCCC(=CCO)C)C | 154.25 | unknown | https://doi.org/10.1055/S-2006-960033 |
| > Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Aromatic monoterpenoids | |||||
| 4-Isopropylbenzyl alcohol | 325 | Click to see CC(C)C1=CC=C(C=C1)CO | 150.22 | unknown | via CMAUP database |
| Cuminaldehyde | 326 | Click to see CC(C)C1=CC=C(C=C1)C=O | 148.20 | unknown | via CMAUP database |
| Linalyl anthranilate | 23535 | Click to see | 273.37 | unknown | via CMAUP database |
| P-Cymene | 7463 | Click to see | 134.22 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Bicyclic monoterpenoids | |||||
| (-)-(1S,4S)-Borneol | 6850744 | Click to see CC1(C2CCC1(C(C2)O)C)C | 154.25 | unknown | via CMAUP database |
| (-)-2-Carene | 6430755 | Click to see CC1=CC2C(C2(C)C)CC1 | 136.23 | unknown | via CMAUP database |
| (-)-3-Carene | 442461 | Click to see CC1=CCC2C(C1)C2(C)C | 136.23 | unknown | via CMAUP database |
| (-)-Camphene | 440966 | Click to see | 136.23 | unknown | via CMAUP database |
| (-)-Myrtanol | 104476 | Click to see | 154.25 | unknown | via CMAUP database |
| (-)-Myrtenyl acetate | 12635160 | Click to see | 194.27 | unknown | via CMAUP database |
| (-)-Sabinene | 11051711 | Click to see CC(C)C12CCC(=C)C1C2 | 136.23 | unknown | via CMAUP database |
| (+-)-alpha-Pinene | 6654 | Click to see | 136.23 | unknown | https://doi.org/10.1055/S-2006-960033 |
| (+-)-Myrtenol | 10582 | Click to see | 152.23 | unknown | via CMAUP database |
| (+)-2-Carene | 78249 | Click to see CC1=CC2C(C2(C)C)CC1 | 136.23 | unknown | via CMAUP database |
| (+)-3-Carene | 443156 | Click to see | 136.23 | unknown | via CMAUP database |
| (+)-4-Carene | 71351627 | Click to see | 136.23 | unknown | via CMAUP database |
| (+)-alpha-Pinene | 82227 | Click to see CC1=CCC2CC1C2(C)C | 136.23 | unknown | via CMAUP database |
| (+)-alpha-Thujone | 12304612 | Click to see | 152.23 | unknown | via CMAUP database |
| (+)-Bornyl acetate | 6950274 | Click to see CC(=O)OC1CC2CCC1(C2(C)C)C | 196.29 | unknown | via CMAUP database |
| (+)-Camphene | 92221 | Click to see CC1(C2CCC(C2)C1=C)C | 136.23 | unknown | via CMAUP database |
| (+)-Sabinene | 10887971 | Click to see | 136.23 | unknown | via CMAUP database |
| (1R,2S,4R)-(+)-Bornyl acetate | 443131 | Click to see | 196.29 | unknown | via CMAUP database |
| (1R,4S)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol | 12242824 | Click to see | 154.25 | unknown | via CMAUP database |
| (1R,5R)-6,6-dimethyl-2-methylidenebicyclo[3.1.1]heptan-3-one | 10012081 | Click to see | 150.22 | unknown | via CMAUP database |
| (1R,6R)-3,7,7-trimethylbicyclo[4.1.0]hept-2-ene | 12302456 | Click to see | 136.23 | unknown | via CMAUP database |
| (1S,2R,4S)-(-)-Bornyl acetate | 442460 | Click to see | 196.29 | unknown | via CMAUP database |
| (1S,2S)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol | 12242815 | Click to see CC1(C2CCC1(C(C2)O)C)C | 154.25 | unknown | via CMAUP database |
| (1S,3R,5S)-2(10)-Pinen-3-ol | 12314318 | Click to see | 152.23 | unknown | via CMAUP database |
| (1S,4R)-4-methyl-1-propan-2-ylbicyclo(3.1.0)hexane | 101629835 | Click to see | 138.25 | unknown | via CMAUP database |
| (1S)-2,6,6-Trimethylbicyclo[3.1.1]hept-2-ene | 12223113 | Click to see CC1=CCC2CC1C2(C)C | 136.23 | unknown | via CMAUP database |
| (5S)-4-methylidene-1-propan-2-ylbicyclo[3.1.0]hexane | 6429260 | Click to see | 136.23 | unknown | via CMAUP database |
| (6,6-Dimethylbicyclo(3.1.1)hept-2-en-2-yl)methyl acetate | 61262 | Click to see | 194.27 | unknown | via CMAUP database |
| 2-Carene | 79044 | Click to see CC1=CC2C(C2(C)C)CC1 | 136.23 | unknown | via CMAUP database |
| 3-Carene | 26049 | Click to see CC1=CCC2C(C1)C2(C)C | 136.23 | unknown | via CMAUP database |
| 3-Thujanone | 11027 | Click to see CC1C2CC2(CC1=O)C(C)C | 152.23 | unknown | via CMAUP database |
| 3-Thujanone, (-)- | 12304613 | Click to see | 152.23 | unknown | via CMAUP database |
| 4-Carene, (1S,3R,6R)-(-)- | 530422 | Click to see | 136.23 | unknown | via CMAUP database |
| 4-Methyl-1-propan-2-ylbicyclo[3.1.0]hexan-3-ol | 10550 | Click to see CC1C2CC2(CC1O)C(C)C | 154.25 | unknown | https://doi.org/10.1055/S-2006-960033 |
| alpha Thujene | 6451618 | Click to see | 136.23 | unknown | https://doi.org/10.1055/S-2006-960033 |
| alpha-Bergamotene | 86608 | Click to see | 204.35 | unknown | via CMAUP database |
| alpha-Thujene | 17868 | Click to see | 136.23 | unknown | https://doi.org/10.1055/S-2006-960033 |
| Beta-Pinene | 14896 | Click to see | 136.23 | unknown | https://doi.org/10.1055/S-2006-960033 |
| beta-Thujene | 520384 | Click to see CC1C=CC2(C1C2)C(C)C | 136.23 | unknown | https://doi.org/10.1055/S-2006-960033 |
| Bicyclo[2.2.1]heptan-2-ol, 1,7,7-trimethyl-, exo- | 439569 | Click to see CC1(C2CCC1(C(C2)O)C)C | 154.25 | unknown | via CMAUP database |
| Bicyclo[3.1.0]hexan-1-ol, 2-methyl-5-(1-methylethyl)- | 527259 | Click to see | 154.25 | unknown | https://doi.org/10.1055/S-2006-960033 |
| Bicyclo[3.1.1]hept-3-en-2-ol, 4,6,6-trimethyl-, [1S-(1alpha,2beta,5alpha)]- | 2734021 | Click to see CC1=CC(C2CC1C2(C)C)O | 152.23 | unknown | via CMAUP database |
| Borneol | 64685 | Click to see | 154.25 | unknown | via CMAUP database |
| Borneol, (-)- | 1201518 | Click to see CC1(C2CCC1(C(C2)O)C)C | 154.25 | unknown | via CMAUP database |
| Bornyl acetate | 6448 | Click to see CC(=O)OC1CC2CCC1(C2(C)C)C | 196.29 | unknown | via CMAUP database |
| Bornyl acetate, (-)- | 93009 | Click to see | 196.29 | unknown | via CMAUP database |
| Camphene | 6616 | Click to see | 136.23 | unknown | https://doi.org/10.1055/S-2006-960033 |
| CID 44630107 | 44630107 | Click to see CC1(C2CCC1(C(C2)O)C)C | 154.25 | unknown | via CMAUP database |
| D-Borneol | 6552009 | Click to see | 154.25 | unknown | via CMAUP database |
| d-Isothujone | 249286 | Click to see CC1C2CC2(CC1=O)C(C)C | 152.23 | unknown | via CMAUP database |
| DL-Borneol | 10492 | Click to see CC1(C2CCC1(C(C2)O)C)C | 154.25 | unknown | via CMAUP database |
| Myrtenal | 61130 | Click to see | 150.22 | unknown | via CMAUP database |
| Myrtenal, (A+-)- | 1201529 | Click to see | 150.22 | unknown | via CMAUP database |
| Myrtenol, (-)- | 88301 | Click to see CC1(C2CC=C(C1C2)CO)C | 152.23 | unknown | via CMAUP database |
| Npc126240 | 44630108 | Click to see | 196.29 | unknown | via CMAUP database |
| Npc189036 | 10049 | Click to see | 154.25 | unknown | via CMAUP database |
| Npc256098 | 6427504 | Click to see | 196.29 | unknown | via CMAUP database |
| Npc282305 | 12315151 | Click to see | 154.25 | unknown | via CMAUP database |
| Npc308218 | 439568 | Click to see | 154.25 | unknown | via CMAUP database |
| Pinocarveol, (+-)- | 102667 | Click to see | 152.23 | unknown | via CMAUP database |
| Pinocarveol, trans-(-)- | 1201530 | Click to see CC1(C2CC1C(=C)C(C2)O)C | 152.23 | unknown | via CMAUP database |
| Pinocarvone | 121719 | Click to see CC1(C2CC1C(=C)C(=O)C2)C | 150.22 | unknown | via CMAUP database |
| Sabinene | 18818 | Click to see | 136.23 | unknown | via CMAUP database |
| Sabinene hydrate | 62367 | Click to see CC(C)C12CCC(C1C2)(C)O | 154.25 | unknown | via CMAUP database |
| Sumatra camphor | 657014 | Click to see CC1(C2CCC1(C(C2)O)C)C | 154.25 | unknown | via CMAUP database |
| trans-alpha-Bergaptene | 6428986 | Click to see CC1=CCC2CC1C2(C)CCC=C(C)C | 204.35 | unknown | via CMAUP database |
| trans-Myrtanol | 84880 | Click to see | 154.25 | unknown | via CMAUP database |
| trans-Pinocarveol | 88302 | Click to see | 152.23 | unknown | via CMAUP database |
| trans-Sabinene hydrate acetate | 6430763 | Click to see | 196.29 | unknown | via CMAUP database |
| trans-Sabinenehydrate | 6431628 | Click to see CC(C)C12CCC(C1C2)(C)O | 154.25 | unknown | via CMAUP database |
| trans-Thujone | 6432452 | Click to see CC1C2CC2(CC1=O)C(C)C | 152.23 | unknown | via CMAUP database |
| Tricyclene | 79035 | Click to see | 136.23 | unknown | via CMAUP database |
| Verbenol | 61126 | Click to see | 152.23 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Menthane monoterpenoids | |||||
| (-)-cis-Carveol | 330573 | Click to see CC1=CCC(CC1O)C(=C)C | 152.23 | unknown | via CMAUP database |
| (-)-Isopulegol | 170833 | Click to see CC1CCC(C(C1)O)C(=C)C | 154.25 | unknown | via CMAUP database |
| (-)-Terpinen-4-ol | 5325830 | Click to see CC1=CCC(CC1)(C(C)C)O | 154.25 | unknown | via CMAUP database |
| (-)-trans-Carveol | 94221 | Click to see CC1=CCC(CC1O)C(=C)C | 152.23 | unknown | via CMAUP database |
| (+-)-Piperitone | 6987 | Click to see | 152.23 | unknown |
https://doi.org/10.1055/S-2006-960033 https://doi.org/10.1021/NP50096A019 |
| (+)-alpha-Phellandrene | 443160 | Click to see | 136.23 | unknown | via CMAUP database |
| (+)-alpha-Terpineol | 442501 | Click to see | 154.25 | unknown | via CMAUP database |
| (+)-cis-Carveol | 443177 | Click to see CC1=CCC(CC1O)C(=C)C | 152.23 | unknown | via CMAUP database |
| (+)-Isodihydrocarvone | 443167 | Click to see | 152.23 | unknown | via CMAUP database |
| (+)-Isopiperitenone | 439696 | Click to see | 150.22 | unknown | via CMAUP database |
| (+)-Limonene | 440917 | Click to see | 136.23 | unknown | via CMAUP database |
| (+)-Neoisopulegol | 6553885 | Click to see CC1CCC(C(C1)O)C(=C)C | 154.25 | unknown | via CMAUP database |
| (+)-Piperitone | 61362 | Click to see | 152.23 | unknown | via CMAUP database |
| (+)-Terpinen-4-ol | 2724161 | Click to see CC1=CCC(CC1)(C(C)C)O | 154.25 | unknown | via CMAUP database |
| (+)-trans-Carveol | 443178 | Click to see CC1=CCC(CC1O)C(=C)C | 152.23 | unknown | via CMAUP database |
| (1R,2R,5R)-5-Methyl-2-(prop-1-en-2-yl)cyclohexanol | 7057941 | Click to see CC1CCC(C(C1)O)C(=C)C | 154.25 | unknown | via CMAUP database |
| (1R,4R)-Dihydrocarvone | 22227 | Click to see | 152.23 | unknown | via CMAUP database |
| (1S,4R)-1-methyl-4-(prop-1-en-2-yl)cyclohex-2-en-1-ol | 11105550 | Click to see | 152.23 | unknown | via CMAUP database |
| (1S,4S)-Dihydrocarvone | 443183 | Click to see | 152.23 | unknown | via CMAUP database |
| (1S,6S)-3-methyl-6-(propan-2-yl)cyclohex-2-en-1-ol | 12314336 | Click to see | 154.25 | unknown | via CMAUP database |
| (6R)-3-Methyl-6-(1-methylethenyl)-2-cyclohexen-1-one | 439733 | Click to see | 150.22 | unknown | via CMAUP database |
| (L)-alpha-terpineol | 443162 | Click to see | 154.25 | unknown | via CMAUP database |
| 1-p-Menthen-9-al | 520440 | Click to see | 152.23 | unknown | via CMAUP database |
| 1,6-Dihydrocarvone | 24473 | Click to see | 152.23 | unknown | via CMAUP database |
| 2-Cyclohexen-1-ol, 1-methyl-4-(1-methylethenyl)-, (1R,4R)-rel- | 111274 | Click to see | 152.23 | unknown | via CMAUP database |
| 2-Cyclohexen-1-ol, 1-methyl-4-(1-methylethenyl)-, trans- | 12618691 | Click to see | 152.23 | unknown | via CMAUP database |
| 2-Cyclohexen-1-ol, 1-methyl-4-(1-methylethyl)-, (1R,4R)-rel- | 122485 | Click to see | 154.25 | unknown | via CMAUP database |
| 2-Cyclohexen-1-ol, 1-methyl-4-(1-methylethyl)-, (1R,4S)-rel- | 122484 | Click to see | 154.25 | unknown | via CMAUP database |
| 2-Cyclohexen-1-ol, 3-methyl-6-(1-methylethyl)-, (1R,6R)-rel- | 85568 | Click to see | 154.25 | unknown | via CMAUP database |
| 2-Menthene | 517974 | Click to see | 138.25 | unknown | via CMAUP database |
| 3-Cyclohexen-1-ol, 4-methyl-1-(1-methylethyl)-, acetate | 20960 | Click to see CC1=CCC(CC1)(C(C)C)OC(=O)C | 196.29 | unknown | via CMAUP database |
| 4-Methyl-beta-methylenecyclohex-3-ene-1-ethanol | 527143 | Click to see CC1=CCC(CC1)C(=C)CO | 152.23 | unknown | via CMAUP database |
| 4-Terpineol, (+/-)- | 11230 | Click to see CC1=CCC(CC1)(C(C)C)O | 154.25 | unknown |
https://doi.org/10.1021/NP50096A019 https://doi.org/10.1055/S-2006-960033 |
| alpha-PHELLANDRENE | 7460 | Click to see CC1=CCC(C=C1)C(C)C | 136.23 | unknown | via CMAUP database |
| Alpha-Terpinene | 7462 | Click to see | 136.23 | unknown | via CMAUP database |
| Alpha-Terpineol | 17100 | Click to see | 154.25 | unknown |
https://doi.org/10.1021/NP50096A019 https://doi.org/10.1055/S-2006-960033 |
| alpha-Terpinyl acetate | 111037 | Click to see CC1=CCC(CC1)C(C)(C)OC(=O)C | 196.29 | unknown | via CMAUP database |
| alpha-Terpinyl acetate, (+)- | 11469649 | Click to see | 196.29 | unknown | via CMAUP database |
| Beta-Phellandrene | 11142 | Click to see CC(C)C1CCC(=C)C=C1 | 136.23 | unknown | https://doi.org/10.1055/S-2006-960033 |
| Beta-Terpineol | 8748 | Click to see | 154.25 | unknown | via CMAUP database |
| Carveol | 7438 | Click to see | 152.23 | unknown | via CMAUP database |
| Carvone, (-)- | 439570 | Click to see | 150.22 | unknown | via CMAUP database |
| Carvone, (+-)- | 7439 | Click to see | 150.22 | unknown | via CMAUP database |
| Carvone, (+)- | 16724 | Click to see CC1=CCC(CC1=O)C(=C)C | 150.22 | unknown | via CMAUP database |
| cis-Piperitol | 85567 | Click to see | 154.25 | unknown | https://doi.org/10.1055/S-2006-960033 |
| cis-Piperitol, acetate | 6427492 | Click to see | 196.29 | unknown | via CMAUP database |
| Isopiperitenone | 79036 | Click to see | 150.22 | unknown | via CMAUP database |
| Isopulegol | 24585 | Click to see CC1CCC(C(C1)O)C(=C)C | 154.25 | unknown | via CMAUP database |
| Isopulegol, (+)- | 1268090 | Click to see | 154.25 | unknown | via CMAUP database |
| l-Menthol | 16666 | Click to see CC1CCC(C(C1)O)C(C)C | 156.26 | unknown | via CMAUP database |
| l-Piperitone | 107561 | Click to see CC1=CC(=O)C(CC1)C(C)C | 152.23 | unknown | via CMAUP database |
| Limonen-4-ol | 527428 | Click to see | 152.23 | unknown | via CMAUP database |
| Limonene, (-)- | 439250 | Click to see | 136.23 | unknown | via CMAUP database |
| Limonene, (+/-)- | 22311 | Click to see CC1=CCC(CC1)C(=C)C | 136.23 | unknown | https://doi.org/10.1055/S-2006-960033 |
| Menthol | 1254 | Click to see | 156.26 | unknown | via CMAUP database |
| p-Menth-1-en-3-ol | 10282 | Click to see CC1=CC(C(CC1)C(C)C)O | 154.25 | unknown | via CMAUP database |
| p-Menth-3-en-1-ol | 11468 | Click to see | 154.25 | unknown | via CMAUP database |
| p-Mentha-1,3,8-triene | 176983 | Click to see CC1=CC=C(CC1)C(=C)C | 134.22 | unknown | via CMAUP database |
| Phellandral | 89488 | Click to see | 152.23 | unknown | via CMAUP database |
| Pulegol | 92793 | Click to see CC1CCC(=C(C)C)C(C1)O | 154.25 | unknown | via CMAUP database |
| Terpinolene | 11463 | Click to see | 136.23 | unknown | via CMAUP database |
| trans-1-Methyl-4-(1-methylvinyl)cyclohex-2-en-1-ol | 155626 | Click to see | 152.23 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids | |||||
| (-)-Isocaryophyllene | 5281522 | Click to see | 204.35 | unknown | via CMAUP database |
| (+)-alpha-Muurolene | 12306049 | Click to see | 204.35 | unknown | via CMAUP database |
| (+)-beta-Caryophyllene | 20831623 | Click to see | 204.35 | unknown | via CMAUP database |
| (+)-Delta-cadinol | 11990360 | Click to see | 222.37 | unknown | via CMAUP database |
| (+)-gamma-Gurjunene | 91748784 | Click to see CC1CCC(C=C2C1CCC2C)C(=C)C | 204.35 | unknown | via CMAUP database |
| (1R,2S,7S,8S)-1,3-dimethyl-8-propan-2-yltricyclo[4.4.0.02,7]dec-3-ene | 92042749 | Click to see CC1=CCC2C3C1C2(CCC3C(C)C)C | 204.35 | unknown | via CMAUP database |
| (1R,4R,4aS,8aS)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol | 91752279 | Click to see | 222.37 | unknown | via CMAUP database |
| (1R,4R,5R,9S)-4,5-epoxycaryophyllan-8(13)-ene | 1742211 | Click to see | 220.35 | unknown | via CMAUP database |
| (1Z,4E)-2,6,6,9-tetramethylcycloundeca-1,4,8-triene | 45115091 | Click to see CC1=CCC(C=CCC(=CCC1)C)(C)C | 204.35 | unknown | via CMAUP database |
| (4Z)-4,11,11-trimethyl-8-methylidenebicyclo[7.2.0]undec-4-ene | 5322111 | Click to see CC1=CCCC(=C)C2CC(C2CC1)(C)C | 204.35 | unknown | via CMAUP database |
| (Z,E)-alpha-Farnesene | 5362889 | Click to see CC(=CCCC(=CCC=C(C)C=C)C)C | 204.35 | unknown | via CMAUP database |
| (Z)-caryophyllene | 6429301 | Click to see | 204.35 | unknown | via CMAUP database |
| 1-Isopropyl-4,7-dimethyl-1,3,4,5,6,8a-hexahydro-4a(2H)-naphthalenol | 519857 | Click to see | 222.37 | unknown | via CMAUP database |
| 1,2,4a,5,6,8a-Hexahydro-4,7-dimethyl-1-(1-methylethyl)naphthalene | 101708 | Click to see | 204.35 | unknown | via CMAUP database |
| 1,3-Dimethyl-8-(1-methylethyl)-tricyclo(4.4.0.02,7)dec-3-ene | 25245021 | Click to see | 204.35 | unknown | via CMAUP database |
| 1,6,10-Dodecatrien-3-ol, 3,7,11-trimethyl- | 8888 | Click to see | 222.37 | unknown | via CMAUP database |
| 2-Isopropenyl-1-methyl-4-(1-methylethylidene)-1-vinylcyclohexane | 6432312 | Click to see CC(=C1CCC(C(C1)C(=C)C)(C)C=C)C | 204.35 | unknown | via CMAUP database |
| 3,4-Dihydrocadalene | 528708 | Click to see CC1=CCC(C2=C1C=CC(=C2)C)C(C)C | 200.32 | unknown | via CMAUP database |
| 3,7-Dimethyl-4-(propan-2-yl)-3a,3b,4,5,6,7-hexahydro-1H-cyclopenta(1,3)cyclopropa(1,2)benzene | 86609 | Click to see | 204.35 | unknown | via CMAUP database |
| 4,11,11-Trimethyl-8-methylene-5-oxatricyclo(8.2.0.0(4,6))dodecane, (1R,4R,6R,10S)- | 6604672 | Click to see CC1(CC2C1CCC3(C(O3)CCC2=C)C)C | 220.35 | unknown | via CMAUP database |
| 4,12,12-Trimethyl-9-methylene-5-oxatricyclo(8.2.0.04,6)dodecane | 14350 | Click to see | 220.35 | unknown | via CMAUP database |
| 7,11-Dimethyl-3-methylene-1,6,10-dodecatriene | 10407 | Click to see | 204.35 | unknown | via CMAUP database |
| alpha-Copaene | 70678558 | Click to see CC1=CCC2C3C1C2(CCC3C(C)C)C | 204.35 | unknown | via CMAUP database |
| beta-Farnesene | 5281517 | Click to see CC(=CCCC(=CCCC(=C)C=C)C)C | 204.35 | unknown | via CMAUP database |
| beta-Farnesene, (6Z)- | 5317319 | Click to see CC(=CCCC(=CCCC(=C)C=C)C)C | 204.35 | unknown | via CMAUP database |
| Bicyclo[4.4.0]dec-1-ene, 2-isopropyl-5-methyl-9-methylene- | 595137 | Click to see CC1CCC(=C2C1CCC(=C)C2)C(C)C | 204.35 | unknown | via CMAUP database |
| Cadin-4-en-10-ol | 519662 | Click to see | 222.37 | unknown | via CMAUP database |
| Cadinol | 6428423 | Click to see | 222.37 | unknown | via CMAUP database |
| Caryophyllene | 5281515 | Click to see CC1=CCCC(=C)C2CC(C2CC1)(C)C | 204.35 | unknown | via CMAUP database |
| Caryophyllene oxide | 1742210 | Click to see | 220.35 | unknown | via CMAUP database |
| Caryophyllene,alpha + beta mixt. | 5354499 | Click to see | 204.35 | unknown | via CMAUP database |
| cis-Nerolidol | 5320128 | Click to see CC(=CCCC(=CCCC(C)(C=C)O)C)C | 222.37 | unknown | via CMAUP database |
| Copaene | 12303902 | Click to see CC1=CCC2C3C1C2(CCC3C(C)C)C | 204.35 | unknown | via CMAUP database |
| Copaene | 19725 | Click to see CC1=CCC2C3C1C2(CCC3C(C)C)C | 204.35 | unknown | via CMAUP database |
| Copaene, (+)- | 636457 | Click to see | 204.35 | unknown | via CMAUP database |
| Cubebene | 518814 | Click to see CC1CCC(C2C13C2C(=C)CC3)C(C)C | 204.35 | unknown | via CMAUP database |
| Cubenol | 11770062 | Click to see CC1CCC(C2C1(CCC(=C2)C)O)C(C)C | 222.37 | unknown | via CMAUP database |
| delta-Amorphene | 12306059 | Click to see | 204.35 | unknown | via CMAUP database |
| Elixene | 94254 | Click to see | 204.35 | unknown | via CMAUP database |
| Farnesene | 5281516 | Click to see | 204.35 | unknown | via CMAUP database |
| gamma-Cadinene | 6432404 | Click to see | 204.35 | unknown | https://doi.org/10.1055/S-2006-960033 |
| gamma-Cadinene | 15094 | Click to see CC1=CC2C(CC1)C(=C)CCC2C(C)C | 204.35 | unknown | https://doi.org/10.1055/S-2006-960033 |
| gamma-Gurjunene | 90805 | Click to see CC1CCC(C=C2C1CCC2C)C(=C)C | 204.35 | unknown | via CMAUP database |
| Humulene | 5281520 | Click to see | 204.35 | unknown | via CMAUP database |
| Nerolidol | 5284507 | Click to see | 222.37 | unknown | via CMAUP database |
| Npc14576 | 6432083 | Click to see | 204.35 | unknown | via CMAUP database |
| Npc16157 | 13240188 | Click to see | 220.35 | unknown | via CMAUP database |
| Npc254770 | 12302222 | Click to see | 222.37 | unknown | via CMAUP database |
| Npc294136 | 14757966 | Click to see | 204.35 | unknown | via CMAUP database |
| Npc307011 | 442355 | Click to see | 204.35 | unknown | via CMAUP database |
| Npc57877 | 6431302 | Click to see | 222.37 | unknown | via CMAUP database |
| Npc91574 | 12306054 | Click to see | 204.35 | unknown | via CMAUP database |
| tau-Muurolol | 6432221 | Click to see CC1=CC2C(CCC(C2CC1)(C)O)C(C)C | 222.37 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Aromadendrane sesquiterpenoids / 5,10-cycloaromadendrane sesquiterpenoids | |||||
| (1aR,4aR,7S,7aS,7bS)-1,1,7-trimethyl-4-methylidene-2,3,4a,5,6,7,7a,7b-octahydro-1aH-cyclopropa(e)azulene | 44584667 | Click to see | 204.35 | unknown | via CMAUP database |
| (1aS,4aS,7aS,7bR)-1,1,7-trimethyl-4-methylidene-2,3,4a,5,6,7,7a,7b-octahydro-1aH-cyclopropa[e]azulene | 91746456 | Click to see CC1CCC2C1C3C(C3(C)C)CCC2=C | 204.35 | unknown | https://doi.org/10.1055/S-2006-960033 |
| [-]-Isoaromadendrene[V] | 21775889 | Click to see | 204.35 | unknown | via CMAUP database |
| 1H-Cycloprop(e)azulene, decahydro-1,1,7-trimethyl-4-methylene-, (1aR-(1aalpha,4abeta,7alpha,7abeta,7balpha))- | 91354 | Click to see | 204.35 | unknown | https://doi.org/10.1055/S-2006-960033 |
| 1H-Cycloprop[e]azulen-7-ol, decahydro-1,1,7-trimethyl-4-methylene-, [1ar-(1aalpha,4aalpha,7beta,7abeta,7balpha)]- | 6432640 | Click to see CC1(C2C1C3C(CCC3(C)O)C(=C)CC2)C | 220.35 | unknown | via CMAUP database |
| Allo-Aromadendrene | 42608158 | Click to see CC1CCC2C1C3C(C3(C)C)CCC2=C | 204.35 | unknown | via CMAUP database |
| Alloaromadendren | 91746537 | Click to see | 204.35 | unknown | via CMAUP database |
| Alloaromadendrene | 10899740 | Click to see | 204.35 | unknown | via CMAUP database |
| beta-Spathulenol | 522266 | Click to see | 220.35 | unknown | via CMAUP database |
| Npc143639 | 6432706 | Click to see | 220.35 | unknown | via CMAUP database |
| Spathulenol | 92231 | Click to see CC1(C2C1C3C(CCC3(C)O)C(=C)CC2)C | 220.35 | unknown | via CMAUP database |
| Spathulenol, (-)- | 13854255 | Click to see | 220.35 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Bicyclogermacrane and isolepidozane sesquiterpenoids | |||||
| (+)-Bicyclogermacrene | 5315347 | Click to see | 204.35 | unknown | via CMAUP database |
| (1S,2E,10R)-3,7,11,11-tetramethylbicyclo[8.1.0]undeca-2,6-diene | 44583886 | Click to see | 204.35 | unknown | via CMAUP database |
| (1S,2E,6E,10R)-3,7,11,11-tetramethylbicyclo[8.1.0]undeca-2,6-diene | 13894533 | Click to see CC1=CCCC(=CC2C(C2(C)C)CC1)C | 204.35 | unknown | via CMAUP database |
| Bicyclogermacrene | 13894537 | Click to see CC1=CCCC(=CC2C(C2(C)C)CC1)C | 204.35 | unknown | via CMAUP database |
| trans-Bicyclogermacradiene | 11820258 | Click to see | 204.35 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Elemane sesquiterpenoids | |||||
| alpha-Elemol | 6429032 | Click to see CC(=C)C1CC(CCC1(C)C=C)C(C)(C)O | 222.37 | unknown | via CMAUP database |
| Cyclohexane, 1-ethenyl-1-methyl-2,4-bis(1-methylethenyl)-, (1R,2R,4S)- | 9859094 | Click to see | 204.35 | unknown | via CMAUP database |
| Cyclohexane, 1-ethenyl-1-methyl-2,4-bis(1-methylethenyl)-, (1R,2R,4S)-rel- | 10583 | Click to see | 204.35 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Eudesmane, isoeudesmane or cycloeudesmane sesquiterpenoids | |||||
| 10-epi-gamma-Eudesmol | 6430754 | Click to see | 222.37 | unknown | via CMAUP database |
| 2-(4a,8-dimethyl-2,3,4,5,6,7-hexahydro-1H-naphthalen-2-yl)propan-2-ol | 518516 | Click to see CC1=C2CC(CCC2(CCC1)C)C(C)(C)O | 222.37 | unknown | via CMAUP database |
| Beta-Selinene | 442393 | Click to see | 204.35 | unknown | via CMAUP database |
| Npc246543 | 6432455 | Click to see | 204.35 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Germacrane sesquiterpenoids | |||||
| (+)-Germacrene D | 24771782 | Click to see CC1=CCCC(=C)C=CC(CC1)C(C)C | 204.35 | unknown | via CMAUP database |
| (1E)-1-methyl-5-methylidene-8-propan-2-ylcyclodeca-1,6-diene | 74764030 | Click to see CC1=CCCC(=C)C=CC(CC1)C(C)C | 204.35 | unknown | via CMAUP database |
| (1Z)-1-methyl-5-methylidene-8-propan-2-ylcyclodeca-1,6-diene | 92003564 | Click to see | 204.35 | unknown | via CMAUP database |
| (6E,8S)-1-methyl-5-methylidene-8-propan-2-ylcyclodeca-1,6-diene | 49796490 | Click to see CC1=CCCC(=C)C=CC(CC1)C(C)C | 204.35 | unknown | via CMAUP database |
| 1-Hydroxy-1,7-dimethyl-4-isopropyl-2,7-cyclodecadiene | 5367550 | Click to see | 222.37 | unknown | via CMAUP database |
| 1-Methyl-5-methylene-8-(1-methylethyl)-1,6-cyclodecadiene | 6436582 | Click to see CC1=CCCC(=C)C=CC(CC1)C(C)C | 204.35 | unknown | via CMAUP database |
| 1,6-Cyclodecadiene, 1-methyl-5-methylene-8-(1-methylethyl)- | 5373727 | Click to see | 204.35 | unknown | via CMAUP database |
| Germacrene B | 5281519 | Click to see CC1=CCCC(=CCC(=C(C)C)CC1)C | 204.35 | unknown | via CMAUP database |
| Germacrene D | 5317570 | Click to see CC1=CCCC(=C)C=CC(CC1)C(C)C | 204.35 | unknown | via CMAUP database |
| germacrene D-4-ol | 5352847 | Click to see CC1=CCCC(C=CC(CC1)C(C)C)(C)O | 222.37 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Trichothecenes | |||||
| (1S,2R,7R,9R,10R,11S,12R)-3,10,11-trihydroxy-2-(hydroxymethyl)-1,5-dimethylspiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2'-oxirane]-4-one | 6325746 | Click to see | 312.31 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Prenol lipids / Triterpenoids | |||||
| beta-Amyrine | 15942855 | Click to see | 426.70 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Steroids and steroid derivatives / Estrane steroids / Estrogens and derivatives | |||||
| (13S)-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,16,17-triol | 16757678 | Click to see | 288.40 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Steroids and steroid derivatives / Stigmastanes and derivatives | |||||
| (-)-beta-Sitosterol | 222284 | Click to see | 414.70 | unknown | via CMAUP database |
| beta-Sitosterol 3-O-beta-D-galactopyranoside | 296119 | Click to see CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC5C(C(C(C(O5)CO)O)O)O)C)C)C(C)C | 576.80 | unknown | https://doi.org/10.1016/0031-9422(94)00965-V |
| Sitogluside | 5742590 | Click to see CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC5C(C(C(C(O5)CO)O)O)O)C)C)C(C)C | 576.80 | unknown | https://doi.org/10.1016/0031-9422(94)00965-V |
| > Organic acids and derivatives / Carboxylic acids and derivatives / Carboxylic acid derivatives / Carboxylic acid esters | |||||
| Heptyl acetate | 8159 | Click to see CCCCCCCOC(=O)C | 158.24 | unknown | via CMAUP database |
| Hexyl acetate | 8908 | Click to see | 144.21 | unknown | via CMAUP database |
| Isobutyl Acetate | 8038 | Click to see | 116.16 | unknown | via CMAUP database |
| > Organic acids and derivatives / Carboxylic acids and derivatives / Tricarboxylic acids and derivatives | |||||
| Acetylanonamine | 6441254 | Click to see CC1CC(=CCOC(=O)C)C(=O)OC2CCN(CC=C(C2=O)COC(=O)C1(C)O)C | 423.50 | unknown | via CMAUP database |
| > Organic acids and derivatives / Keto acids and derivatives / Alpha-keto acids and derivatives | |||||
| Ethyl pyruvate | 12041 | Click to see CCOC(=O)C(=O)C | 116.11 | unknown | via CMAUP database |
| Ethyl Pyruvate-3,3,3-d3 | 12247697 | Click to see | 119.13 | unknown | via CMAUP database |
| > Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Cyclitols and derivatives / Quinic acids and derivatives | |||||
| (1S,3R,4R,5R)-3-[3-(3,4-dihydroxyphenyl)prop-2-enoyloxy]-1,4,5-trihydroxy-cyclohexanecarboxylic acid | 9476 | Click to see C1C(C(C(CC1(C(=O)O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)O | 354.31 | unknown | via CMAUP database |
| > Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Primary alcohols | |||||
| 1-Butanol | 263 | Click to see | 74.12 | unknown | via CMAUP database |
| 4-Methyl-1-pentanol | 12296 | Click to see CC(C)CCCO | 102.17 | unknown | via CMAUP database |
| Isoamyl alcohol | 31260 | Click to see CC(C)CCO | 88.15 | unknown | via CMAUP database |
| Isobutanol | 6560 | Click to see | 74.12 | unknown | via CMAUP database |
| Prenol | 11173 | Click to see CC(=CCO)C | 86.13 | unknown | via CMAUP database |
| > Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Secondary alcohols | |||||
| (1R,4S)-4-tert-butylcyclohex-2-en-1-ol | 6427100 | Click to see CC(C)(C)C1CCC(C=C1)O | 154.25 | unknown | via CMAUP database |
| (1S)-cyclohex-2-en-1-ol | 5325854 | Click to see C1CC=CC(C1)O | 98.14 | unknown | via CMAUP database |
| 2-Cyclohexen-1-OL | 13198 | Click to see | 98.14 | unknown | via CMAUP database |
| 2-Cyclohexen-1-ol, (1R)- | 10486804 | Click to see C1CC=CC(C1)O | 98.14 | unknown | via CMAUP database |
| 3-Cyclohexen-1-ol | 556685 | Click to see C1CC(CC=C1)O | 98.14 | unknown | via CMAUP database |
| 4-tert-Butylcyclohex-2-en-1-ol | 141999 | Click to see | 154.25 | unknown | via CMAUP database |
| > Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Tertiary alcohols | |||||
| (2E,6E,8E)-10,11-dihydroxy-N-(2-hydroxy-2-methylpropyl)dodeca-2,6,8-trienamide | 132575017 | Click to see CC(C(C=CC=CCCC=CC(=O)NCC(C)(C)O)O)O | 297.39 | unknown | https://doi.org/10.1016/J.BMCL.2015.12.015 |
| (2e,6e,8e)-N-(2-hydroxy-2-methylpropyl)-10-oxo-2,6,8-decatrienamide | 166033765 | Click to see | 251.32 | unknown | https://doi.org/10.1016/J.CCLET.2012.09.022 |
| (2e,7e,9e)-N-(2-hydroxy-2-methylpropyl)-6,11-dioxo-2,7,9-dodecatrienamide | 132575014 | Click to see CC(=O)C=CC=CC(=O)CCC=CC(=O)NCC(C)(C)O | 293.36 | unknown | https://doi.org/10.1016/J.CCLET.2012.09.022 |
| 2-Methyl-3-buten-2-ol | 8257 | Click to see | 86.13 | unknown | via CMAUP database |
| 3,7-Dimethylocta-1,5,7-trien-3-ol | 5366264 | Click to see | 152.23 | unknown | via CMAUP database |
| Bungeanool | 14135318 | Click to see CCC=CCC=CCCC=CC=CC(=O)NCC(C)(C)O | 291.40 | unknown | https://doi.org/10.1016/S0031-9422(97)84398-1 |
| Hydroxyl-gamma-isosanshool | 72727915 | Click to see | 289.40 | unknown | https://doi.org/10.1248/CPB.36.2362 |
| Linalool oxide (5-ring) | 102611 | Click to see | 170.25 | unknown | via CMAUP database |
| > Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Glycosyl compounds / Phenolic glycosides | |||||
| 2-(Hydroxymethyl)-6-(4-hydroxyphenoxy)oxane-3,4,5-triol | 346 | Click to see C1=CC(=CC=C1O)OC2C(C(C(C(O2)CO)O)O)O | 272.25 | unknown | https://doi.org/10.1016/0031-9422(94)00965-V |
| Arbutin | 440936 | Click to see C1=CC(=CC=C1O)OC2C(C(C(C(O2)CO)O)O)O | 272.25 | unknown | https://doi.org/10.1016/0031-9422(94)00965-V |
| Glucoside,6-dimethoxyphenyl, D | 5885030 | Click to see | 372.40 | unknown | via CMAUP database |
| Syringin | 5316860 | Click to see | 372.40 | unknown | via CMAUP database |
| > Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Aldehydes / Medium-chain aldehydes | |||||
| (S)-2,6-Dimethylheptanal | 14139287 | Click to see CC(C)CCCC(C)C=O | 142.24 | unknown | via CMAUP database |
| 2,4-Heptadienal | 5283321 | Click to see CCC=CC=CC=O | 110.15 | unknown | via CMAUP database |
| 2,4-Hexadienal | 637564 | Click to see | 96.13 | unknown | via CMAUP database |
| 2,6-Dimethyl-2-heptenal | 5352222 | Click to see CC(C)CCC=C(C)C=O | 140.22 | unknown | via CMAUP database |
| 6-Methylheptanal | 104307 | Click to see CC(C)CCCCC=O | 128.21 | unknown | via CMAUP database |
| Decanal | 8175 | Click to see | 156.26 | unknown | via CMAUP database |
| Hexanal | 6184 | Click to see | 100.16 | unknown | via CMAUP database |
| Isodecylaldehyde | 14862 | Click to see | 156.26 | unknown | via CMAUP database |
| Nonanal | 31289 | Click to see CCCCCCCCC=O | 142.24 | unknown | via CMAUP database |
| Octanal | 454 | Click to see | 128.21 | unknown | via CMAUP database |
| > Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Aldehydes / Short-chain aldehydes | |||||
| Acetaldehyde | 177 | Click to see | 44.05 | unknown | via CMAUP database |
| > Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Alpha,beta-unsaturated aldehydes / Enals | |||||
| Acrolein | 7847 | Click to see C=CC=O | 56.06 | unknown | via CMAUP database |
| Crotonaldehyde | 447466 | Click to see CC=CC=O | 70.09 | unknown | via CMAUP database |
| Crotonaldehyde, (2Z)- | 643950 | Click to see | 70.09 | unknown | via CMAUP database |
| > Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Alpha,beta-unsaturated ketones / Enones | |||||
| Methyl vinyl ketone | 6570 | Click to see | 70.09 | unknown | via CMAUP database |
| > Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Cyclic ketones | |||||
| Cyclooctanone | 10403 | Click to see | 126.20 | unknown | via CMAUP database |
| > Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Cyclic ketones / Cyclohexenones | |||||
| 4-Isopropyl-2-cyclohexen-1-one, (R)-(-)- | 642520 | Click to see | 138.21 | unknown | via CMAUP database |
| 4-Isopropyl-2-cyclohexenone | 92780 | Click to see CC(C)C1CCC(=O)C=C1 | 138.21 | unknown | via CMAUP database |
| > Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Ketones | |||||
| (R-(E))-5-Isopropyl-8-methylnona-6,8-dien-2-one | 16058296 | Click to see CC(C)C(CCC(=O)C)C=CC(=C)C | 194.31 | unknown | via CMAUP database |
| 2-Tridecanone | 11622 | Click to see | 198.34 | unknown | via CMAUP database |
| 3-Nonanone | 61235 | Click to see CCCCCCC(=O)CC | 142.24 | unknown | via CMAUP database |
| 6-Methyl-5-hepten-2-one | 9862 | Click to see | 126.20 | unknown | via CMAUP database |
| > Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Ketones / Alpha-diketones | |||||
| Butanedione | 650 | Click to see | 86.09 | unknown | via CMAUP database |
| > Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Phenylketones / Alkyl-phenylketones | |||||
| 2',4'-Dimethylacetophenone | 6985 | Click to see CC1=CC(=C(C=C1)C(=O)C)C | 148.20 | unknown | via CMAUP database |
| Acetosyringone | 17198 | Click to see CC(=O)C1=CC(=C(C(=C1)OC)O)OC | 196.20 | unknown | via CMAUP database |
| Xanthoxylin | 66654 | Click to see | 196.20 | unknown | https://doi.org/10.1002/PTR.2650070111 |
| > Organoheterocyclic compounds / Dihydrofurans / Furanones / Butenolides | |||||
| 5-Hexa-1,2-dienylidenefuran-2-one | 6324998 | Click to see | 162.18 | unknown | via CMAUP database |
| Vulpinic Acid | 54690323 | Click to see | 322.30 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Dioxanes / 1,2-dioxanes | |||||
| (Z)-Ascaridole | 12308625 | Click to see | 168.23 | unknown | via CMAUP database |
| Ascaridole | 10545 | Click to see CC(C)C12CCC(C=C1)(OO2)C | 168.23 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Epoxides | |||||
| 12-Oxabicyclo[9.1.0]dodeca-3,7-diene, 1,5,5,8-tetramethyl- | 524129 | Click to see CC1=CCC(C=CCC2(C(O2)CC1)C)(C)C | 220.35 | unknown | via CMAUP database |
| 2,2-Dimethyl-3-(3-methylenepent-4-enyl)oxirane | 122371 | Click to see CC1(C(O1)CCC(=C)C=C)C | 152.23 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Furans / Nitrofurans | |||||
| Npc309856 | 5383729 | Click to see | 181.15 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Heteroaromatic compounds | |||||
| 3-Methyl-2-(3-methylbut-2-enyl)-furan | 84825 | Click to see | 150.22 | unknown | via CMAUP database |
| Perillene | 68316 | Click to see | 150.22 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Isoindoles and derivatives / Isoindolines / Isoindolones | |||||
| (2E)-(2-Ethyl-3-oxo-2,3-dihydro-1H-isoindol-1-ylidene)acetaldehyde | 11735809 | Click to see | 201.22 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Oxanes | |||||
| 1,8-Cineole | 2758 | Click to see | 154.25 | unknown | via CMAUP database |
| 2-Oxabicyclo[2.2.2]octan-6-ol, 1,3,3-trimethyl-, 6-acetate | 175002 | Click to see | 212.28 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Oxepanes | |||||
| (+)-trans-Limonene oxide | 449290 | Click to see CC(=C)C1CCC2(C(C1)O2)C | 152.23 | unknown | via CMAUP database |
| Limonene oxide, trans-(-)- | 8029780 | Click to see | 152.23 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Pyrans | |||||
| (+-)-Nerol oxide | 61275 | Click to see | 152.23 | unknown | via CMAUP database |
| Dehydro-1,8-cineole | 523035 | Click to see | 152.23 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Quinolines and derivatives / Benzoquinolines / Phenanthridines and derivatives | |||||
| 4-methoxy-12H-[1,3]benzodioxolo[5,6-c]phenanthridin-3-one | 6324828 | Click to see | 319.30 | unknown | via CMAUP database |
| Nitidine | 4501 | Click to see | 348.40 | unknown | via CMAUP database |
| Norchelerythrine | 443719 | Click to see COC1=C(C2=CN=C3C(=C2C=C1)C=CC4=CC5=C(C=C43)OCO5)OC | 333.30 | unknown | via CMAUP database |
| Oxychelerythrine | 147279 | Click to see CN1C2=C(C=CC3=CC4=C(C=C32)OCO4)C5=C(C1=O)C(=C(C=C5)OC)OC | 363.40 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Quinolines and derivatives / Furanoquinolines | |||||
| 4,8-dimethoxy-9H-furo[2,3-b]quinolin-7-one | 165368 | Click to see COC1=C2C=CC(=O)C(=C2NC3=C1C=CO3)OC | 245.23 | unknown | via CMAUP database |
| Kokusaginine | 10227 | Click to see COC1=C(C=C2C(=C1)C(=C3C=COC3=N2)OC)OC | 259.26 | unknown | via CMAUP database |
| Skimmianine | 6760 | Click to see COC1=C(C2=C(C=C1)C(=C3C=COC3=N2)OC)OC | 259.26 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Quinolines and derivatives / Quinolones and derivatives / Hydroquinolones | |||||
| Schinifoline | 133504 | Click to see | 257.37 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Quinolines and derivatives / Quinolones and derivatives / Pyranoquinolines | |||||
| (2S)-2,6-dimethyl-2-(4-methylpent-3-enyl)pyrano[3,2-c]quinolin-5-one | 162884484 | Click to see CC(=CCCC1(C=CC2=C(O1)C3=CC=CC=C3N(C2=O)C)C)C | 309.40 | unknown | https://doi.org/10.1016/S0031-9422(00)90870-7 |
| 2,6-Dimethyl-2-(4-methylpent-3-enyl)-3,4-dihydropyrano[3,2-c]quinolin-5-one | 44559726 | Click to see CC(=CCCC1(CCC2=C(O1)C3=CC=CC=C3N(C2=O)C)C)C | 311.40 | unknown | via CMAUP database |
| Zanthobungeanine | 5315422 | Click to see | 271.31 | unknown | via CMAUP database |
| Zanthosimuline | 5315426 | Click to see CC(=CCCC1(C=CC2=C(O1)C3=CC=CC=C3N(C2=O)C)C)C | 309.40 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Tetrahydrofurans | |||||
| Lilac aldehyde | 155007 | Click to see | 168.23 | unknown | via CMAUP database |
| Linalool oxide | 22310 | Click to see CC1(CCC(O1)C(C)(C)O)C=C | 170.25 | unknown | via CMAUP database |
| Linalool oxide, cis- | 6428573 | Click to see | 170.25 | unknown | via CMAUP database |
| trans-Linalool oxide | 6432254 | Click to see CC1(CCC(O1)C(C)(C)O)C=C | 170.25 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Thienothiophenes | |||||
| 2-t-Butylthieno[2,3-b]thiophene | 602491 | Click to see CC(C)(C)C1=CC2=C(S1)SC=C2 | 196.30 | unknown | via CMAUP database |
| > Organosulfur compounds / Isothiocyanates | |||||
| Methyl isothiocyanate | 11167 | Click to see | 73.12 | unknown | via CMAUP database |
| > Phenylpropanoids and polyketides / Cinnamic acids and derivatives / Cinnamic acid esters | |||||
| 3-Phenyl-2-propenoic acid methyl ester | 7644 | Click to see COC(=O)C=CC1=CC=CC=C1 | 162.18 | unknown | via CMAUP database |
| Methyl cinnamate | 637520 | Click to see COC(=O)C=CC1=CC=CC=C1 | 162.18 | unknown | via CMAUP database |
| > Phenylpropanoids and polyketides / Coumarins and derivatives / Coumarin glycosides | |||||
| 7-[3,4,5-Trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-2-one | 320361 | Click to see C1=CC(=CC2=C1C=CC(=O)O2)OC3C(C(C(C(O3)CO)O)O)O | 324.28 | unknown | via CMAUP database |
| > Phenylpropanoids and polyketides / Flavonoids / Flavans / Catechins | |||||
| (-)-Catechol | 73160 | Click to see | 290.27 | unknown | via CMAUP database |
| (+)-Epicatechin | 182232 | Click to see | 290.27 | unknown | via CMAUP database |
| 2-(3,4-dihydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-3,5,7-triol | 1203 | Click to see | 290.27 | unknown | via CMAUP database |
| Catechin | 9064 | Click to see | 290.27 | unknown | via CMAUP database |
| Epicatechin | 72276 | Click to see | 290.27 | unknown | via CMAUP database |
| > Phenylpropanoids and polyketides / Flavonoids / Flavones / Flavonols | |||||
| 3,5,6-Trihydroxy-4',7'-dimethoxyflavone | 5322058 | Click to see | 330.29 | unknown | https://doi.org/10.1016/0031-9422(94)00965-V |
| Mikanin | 15560536 | Click to see COC1=CC=C(C=C1)C2=C(C(=O)C3=C(C(=C(C=C3O2)OC)OC)O)O | 344.30 | unknown | https://doi.org/10.1002/PTR.2650070111 |
| Quercetin | 5280343 | Click to see | 302.23 | unknown | https://doi.org/10.1016/0031-9422(94)00965-V |
| > Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glycosides / Flavonoid-3-O-glycosides | |||||
| 2-(3,4-Dihydroxyphenyl)-5,7-Dihydroxy-3-(3,4,5-Trihydroxy-6-(Hydroxymethyl)Oxan-2-Yl)Oxychromen-4-One | 5378597 | Click to see | 464.40 | unknown | https://doi.org/10.1016/0031-9422(94)00965-V |
| 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-[(2R,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl]oxychromen-4-one | 5317847 | Click to see | 434.30 | unknown | via CMAUP database |
| 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-2,3-dihydrochromen-4-one | 5317364 | Click to see | 436.40 | unknown | https://doi.org/10.1016/0031-9422(94)00965-V |
| 2-(3,4-Dihydroxyphenyl)-5,7-dihydroxy-4-oxo-4H-1-benzopyran-3-yl 6-deoxyhexopyranoside | 5353915 | Click to see | 448.40 | unknown | https://doi.org/10.1016/0031-9422(94)00965-V |
| 5,7-dihydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-3-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one | 94858662 | Click to see | 508.40 | unknown | via CMAUP database |
| acs.jmedchem.1c00409_ST.657 | 5878729 | Click to see | 434.30 | unknown | https://doi.org/10.1016/0031-9422(94)00965-V |
| Guaijaverin | 5481224 | Click to see | 434.30 | unknown | https://doi.org/10.1016/0031-9422(94)00965-V |
| Hyperoside | 5281643 | Click to see C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)CO)O)O)O)O)O | 464.40 | unknown |
https://doi.org/10.1016/0031-9422(94)00965-V https://doi.org/10.1002/PTR.2650070111 |
| Isorhamnetin 3-O-glucoside | 5318645 | Click to see | 478.40 | unknown | via CMAUP database |
| Quercitrin | 5280459 | Click to see CC1C(C(C(C(O1)OC2=C(OC3=CC(=CC(=C3C2=O)O)O)C4=CC(=C(C=C4)O)O)O)O)O | 448.40 | unknown |
https://doi.org/10.1002/PTR.2650070111 https://doi.org/10.1016/0031-9422(94)00965-V |
| Rutin | 5280805 | Click to see | 610.50 | unknown | https://doi.org/10.1016/0031-9422(94)00965-V |
| Vitamin P | 5293655 | Click to see | 610.50 | unknown | https://doi.org/10.1016/0031-9422(94)00965-V |
| > Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glycosides / Flavonoid-7-O-glycosides | |||||
| 2-(3,4-dimethoxyphenyl)-3,5-dihydroxy-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one | 162843221 | Click to see | 492.40 | unknown | https://doi.org/10.1016/0031-9422(94)00965-V |
| 3,5-Dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-7-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one | 12302035 | Click to see | 478.40 | unknown | https://doi.org/10.1016/0031-9422(94)00965-V |
| 3,7-Bis(beta-D-glucopyranosyloxy)-3',5-dihydroxy-4'-methoxyflavone | 102574483 | Click to see COC1=C(C=C(C=C1)C2=C(C(=O)C3=C(C=C(C=C3O2)OC4C(C(C(C(O4)CO)O)O)O)O)OC5C(C(C(C(O5)CO)O)O)O)O | 640.50 | unknown | https://doi.org/10.1016/0031-9422(94)00965-V |
| 5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-3-methoxy-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one | 162978396 | Click to see COC1=C(C=C(C=C1)C2=C(C(=O)C3=C(C=C(C=C3O2)OC4C(C(C(C(O4)CO)O)O)O)O)OC)O | 492.40 | unknown | https://doi.org/10.1016/0031-9422(94)00965-V |
| 5-Hydroxy-2-(3-hydroxy-4-methoxyphenyl)-3,7-bis[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]chromen-4-one | 74978282 | Click to see | 640.50 | unknown | https://doi.org/10.1016/0031-9422(94)00965-V |
| 5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-7-[(2S,3R,4S,5S,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one | 163032764 | Click to see | 640.50 | unknown | https://doi.org/10.1016/0031-9422(94)00965-V |
| Dillenetin 7-glucoside | 44258040 | Click to see COC1=C(C=C(C=C1)C2=C(C(=O)C3=C(C=C(C=C3O2)OC4C(C(C(C(O4)CO)O)O)O)O)O)OC | 492.40 | unknown | https://doi.org/10.1016/0031-9422(94)00965-V |
| Hesperetin-7-Rutinoside | 3594 | Click to see | 610.60 | unknown | via CMAUP database |
| Hesperidin | 10621 | Click to see | 610.60 | unknown | via CMAUP database |
| Isorhamnetin 7-glucoside | 6455477 | Click to see | 478.40 | unknown | https://doi.org/10.1016/0031-9422(94)00965-V |
| > Phenylpropanoids and polyketides / Tannins / Hydrolyzable tannins | |||||
| 4-(beta-D-Glucopyranosyloxy)-3-methoxybenzoic acid | 14132337 | Click to see | 330.29 | unknown | via CMAUP database |
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