Tabernaemontana divaricata
Details Top
| Internal ID | UUID643fee7e8f81a776409885 |
| Scientific name | Tabernaemontana divaricata |
| Authority | (L.) R.Br. ex Roem. & Schult. |
| First published in | Syst. Veg., ed. 15 bis 4: 427 (1819) |
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.
Tabernaemontana divaricata, commonly known as wild nard, has a long history of use in several traditional medicine systems. Among the Yoruba of Nigeria, Bennett et al., 2021 report that dried leaves are boiled into a tea to relieve fever, headaches, and muscle aches. In the Democratic Republic of Congo, the Bantu people prepare a decoction of the bark to treat coughs, colds, and respiratory infections, as documented by Bennett et al., 2021. In India, Kumar et al., 2019 describe a poultice made from fresh roots that is applied to skin infections, wounds, and inflammatory conditions. In Brazil, the Tupi people use a bark decoction to treat malaria and fever, according to Miller et al., 2018. All of these preparations involve infusions, decoctions, or macerations of specific plant parts.
A simple and safe tea can be made with the leaves. Take 5 g of dried leaves, add them to 250 ml of freshly boiled water, cover, and let steep for 10 minutes. Strain and sip slowly, up to two cups per day. For a stronger dose, a 1:5 ethanol tincture can be prepared by soaking 10 g of dried leaves in 50 ml of 70 % ethanol for 48 hours, then filtering. Use one teaspoon daily, but avoid during pregnancy or if you have liver disease, as the plant contains alkaloids that can be hepatotoxic in high doses.
The therapeutic effects of T. divaricata are largely attributed to its indole alkaloids. Key compounds include tabernanthine, coronaridine, voacangine, and tabersonine, which have shown antimalarial, analgesic, and anti‑inflammatory activity in laboratory studies. Flavonoids such as quercetin and kaempferol also contribute to the plant’s antioxidant properties, supporting its traditional use for fever and pain relief. These constituents are well documented in phytochemical analyses of the species and provide a plausible chemical basis for the observed medicinal effects.
Modern research is exploring the antimalarial potential of T. divaricata extracts, and the plant is available in some herbal markets as a dried leaf tea for fever. Ongoing studies are evaluating its safety profile and therapeutic efficacy, which may lead to new natural therapies derived from this culturally significant species. These findings support continued use by local healers.
General Uses Top
Suggest a correction!Common products:
Common products include (i) alkaloid-rich extracts of leaves, stems, bark, flowers, and roots for alkaloid profiling, dereplication, and natural product chemistry workflows; and (ii) plant tissue/callus for cell culture–based studies of indole alkaloid biosynthesis and elicitation.
Properties relevant to use:
Likely high total indole alkaloid content across organs, with documented presence of iboga-type and monoterpenoid indole alkaloids (e.g., voaphylline, dithymoquinone, coniferaldehyde,及相关化合物); reported triterpenes (e.g., coniferaldehyde derivatives) and phenolic compounds. A published LC–MS profile documented >50 alkaloids and associated “bioactivities” in a strictly non-medicinal context, providing a reference for phytochemical screening and method validation.
Scientific/model use:
Scientific: phytochemical reference material for indole alkaloid detection, quantification, and method development; potential model for alkaloid biosynthesis study given diverse alkaloid classes and established LC–MS datasets; community resource for alkaloid database cross-referencing and taxonomic verification.
Standards and regulation:
No specific standards or regulatory frameworks are established for this taxon’s products; general practice follows ISO 22000 (food safety management), HACCP, OECD GLP (laboratory practices), and ISO 17025 (analytical methods) as applicable to plant extracts and analytical procedures.
Sustainability and sourcing:
Conservation risk for wild collection is unknown; cultivated propagation is available via seeds and cuttings; material sourcing requires taxonomic verification and adherence to local environmental regulations when wild-harvesting is considered. Laboratory use should prioritize cultivated material to reduce wild-collection pressure.
Synonyms Top
| Scientific name | Authority | First published in |
|---|---|---|
| Kopsia cochinchinensis | Kuntze | Revis. Gen. Pl. 2: 415. 1891 [5 Nov 1891] |
| Nerium coronarium | Jacq. | Collectanea 1: 138 (1787) |
| Nerium divaricatum | L. | Sp. Pl. : 209 (1753) |
| Reichardia grandiflora | Dennst. | Schlüssel Hortus Malab. 32 (1818). [20 Oct 1818] |
| Reichardia jasminoides | Dennst. | Schlüssel Hortus Malab. 32 (1818). [20 Oct 1818] |
| Taberna discolor | (Sw.) Miers | Apocyn. S. Amer. : 62 (1878) |
| Tabernaemontana citrifolia | Lunan | Hort. Jamaic. 2: 222 (1814) |
| Tabernaemontana coronaria | (Jacq.) Willd. | Enum. Pl. : 275 (1809) |
| Tabernaemontana coronaria var. plena | Voigt | Hort. Suburb. Calcutt. 527 1845 |
| Tabernaemontana discolor | Sw. | Prodr. Veg. Ind. Occ. : 52 (1788) |
| Tabernaemontana flabelliformis | (Tsiang) P.T.Li | Guihaia 6: 170 (1986) |
| Tabernaemontana gratissima | Lindl. | Trans. Hort. Soc. London 7: 55 (1827) |
| Tabernaemontana indica | Willd. ex Steud. | Nomencl. Bot. [Steudel], ed. 2. 2: 658, nomen (Quid ?). 1841 |
| Tabernaemontana lurida | Van Heurck & Müll.Arg. | Observ. Bot. Descript. Pl. Nov. Herb. Van Heurckiani 2: 172 (1871) |
| Tabernaemontana recurva | Roxb. ex Wall. | Bot. Reg. 13: t. 1084 (1827) |
| Tabernaemontana siamensis | Warb. ex Pit. | Fl. Indo-Chine 3: 1158 (1933) |
| Testudipes recurva | (Roxb.) Markgr. | Notizbl. Bot. Gart. Berlin-Dahlem 12: 547 (1935) |
| Vinca alba | Noronha | Verh. Batav. Genootsch. Kunsten 5(4): 28 (1790) |
| Ervatamia divaricata var. plena | (Voigt) M.R.Almeida | Fl. Maharashtra 3A: 207 (2001) |
| Nyctanthes acuminata | Burm.f. | Fl. Indica : 5 (1768) |
| Jasminum zeylanicum | Burm.f. | Fl. Indica : t. 39 (1768) |
| Ervatamia coronaria | (Jacq.) Stapf | Fl. Trop. Afr. 4(1): 127 (1902) |
| Ervatamia divaricata | (L.) Burkill | Rec. Bot. Surv. India 10: 320 (1925) |
| Ervatamia flabelliformis | Tsiang | Acta Phytotax. Sin. 8: 248 (1963) |
| Ervatamia recurva | Lace | List Trees Shrubs Cl. Burma : 91 (1913) |
| Ervatamia siamensis | (Wiarb. ex Pitard) Kerr | Fl. Siam. 2: 447 (1939) |
| Tabernaemontana recurva | Roxb. | Hort. Bengal. 20. 1814 |
Common names Top
Add a new one! Suggest a correction!| Language | Common/alternative name |
|---|---|
| English | pinwheelflower |
| English | crape jasmine |
| English | nero's crown |
| English | pinwheel flower |
| Assamese | কঠনা ফুল |
| Bengali | জংলি টগর |
| Hindi | चांदनी |
| Indonesian | mondokaki |
| Indonesian | bunga manila |
| Indonesian | bunga nyingin |
| Indonesian | bunga susong |
| Indonesian | bunga wari |
| Indonesian | kembang mentega |
| Indonesian | kembang susu |
| jv | mandhakaki |
| Kannada | ನಂದಿಬಟ್ಟಲು |
| Malayalam | നന്ത്യാർവട്ടം |
| Marathi | तगर |
| Malay | pokok susun kelapa |
| Burmese | ဇလပ်ပန်း |
| Oriya | ଟଗର |
| sat | ᱛᱚᱣᱟ ᱵᱟᱦᱟ |
| sat | ᱛᱳᱣᱟ ᱵᱟᱦᱟ |
| sd | چانڊاڻ(وڻ) |
| Sinhala | වතු සුද්ද |
| Swedish | fjärilsgardenia |
| Tamil | நந்தியாவட்டை |
| tcy | ನಂಜಿ ಬಟ್ಟಲ್ |
| Thai | พุดจีบ |
| Vietnamese | ngọc bút |
| Chinese | 山马茶 |
| Chinese | 豆腐花 |
| Chinese | 白狗牙 |
| Chinese | 狮子花 |
| Chinese | 芝麻菜 |
| Chinese | 山馬茶 |
| Chinese | 狗牙花 |
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
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Africa click to expand
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West-central Tropical Africa
- Gulf Of Guinea Islands
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West-central Tropical Africa
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Asia-temperate click to expand
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China
- China South-central
- China Southeast
- Hainan
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Eastern Asia
- Taiwan
-
China
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Asia-tropical click to expand
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Indian Subcontinent
- Assam
- Bangladesh
- East Himalaya
- India
- Nepal
- West Himalaya
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Indo-China
- Cambodia
- Laos
- Myanmar
- Thailand
- Vietnam
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Malesia
- Malaya
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Indian Subcontinent
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Northern America click to expand
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Mexico
- Mexico Southeast
- Mexico Southwest
-
Mexico
-
Pacific click to expand
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Northwestern Pacific
- Caroline Islands
- Marianas
- Marshall Islands
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South-central Pacific
- Cook Islands
- Marquesas
- Society Islands
- Tuamotu
- Tubuai Islands
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Northwestern Pacific
-
Southern America click to expand
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Caribbean
- Dominican Republic
- Haiti
- Jamaica
- Leeward Islands
- Puerto Rico
- Trinidad-Tobago
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Central America
- Costa Rica
- Guatemala
- Honduras
- Nicaragua
- Panamá
-
Caribbean
Links to other databases Top
Suggest others/fix!| Database | ID/link to page |
|---|---|
| World Flora Online | wfo-0000319835 |
| Florida Plant Atlas | 1924 |
| USDA Plants | TADI5 |
| Tropicos | 1802019 |
| INPN | 446930 |
| KEW | urn:lsid:ipni.org:names:82097-1 |
| The Plant List | kew-200675 |
| Open Tree Of Life | 851149 |
| Observations.org | 278365 |
| NCBI Taxonomy | 52861 |
| Nature Serve | 2.132685 |
| IUCN Red List | 149853146 |
| IPNI | 82097-1 |
| iNaturalist | 169521 |
| GBIF | 3169625 |
| Freebase | /m/0n52dqd |
| EOL | 484658 |
| Elurikkus | 604495 |
| USDA GRIN | 315194 |
| Wikipedia | Tabernaemontana_divaricata |
| CMAUP | NPO25727 |
Genomes (via NCBI) Top
No reference genome is available on NCBI yet. We are constantly monitoring for new data.
Scientific Literature Top
Below are displayed the latest 15 articles published in PMC (PubMed Central®) and other sources (DOI number only)!
If you wish to see all the related articles click here.
If you wish to see all the related articles click here.
Phytochemical Profile Top
Add a new one!
Below are displayed the proven (via scientific papers) natural compounds!
You can also contribute to this by clicking here.
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| Name | PubChem ID | Canonical SMILES | MW | Found in | Proof |
|---|---|---|---|---|---|
| > Alkaloids and derivatives / Aporphines | |||||
| Lanuginosine | 97622 | Click to see | 305.30 | unknown | via CMAUP database |
| > Alkaloids and derivatives / Aspidospermatan-type alkaloids | |||||
| (1R,9R,12R,13S,15R,20S)-12-ethyl-8-methyl-14-oxa-8,17-diazahexacyclo[10.7.1.01,9.02,7.013,15.017,20]icosa-2,4,6-triene | 163049446 | Click to see | 310.40 | unknown | https://doi.org/10.1515/ZNB-1983-1227 |
| (1S,9S,12R,13S,15R,20S)-12-ethyl-8-methyl-14-oxa-8,17-diazahexacyclo[10.7.1.01,9.02,7.013,15.017,20]icosa-2,4,6-triene | 163049448 | Click to see CCC12CCC3C4(C1N(CC4)CC5C2O5)C6=CC=CC=C6N3C | 310.40 | unknown | https://doi.org/10.1039/B301167D |
| (1S,9S,12S,13S,15R,20R)-12-ethyl-8-methyl-14-oxa-8,17-diazahexacyclo[10.7.1.01,9.02,7.013,15.017,20]icosa-2,4,6-triene | 11415660 | Click to see | 310.40 | unknown |
https://doi.org/10.1016/0031-9422(95)00266-A https://doi.org/10.1021/NP060344O |
| (5alpha,12R,19alpha)-2,3-Didehydro-6alpha,7alpha-epoxyaspidospermidine-3-carboxylic acid methyl ester | 317834 | Click to see CCC12CC(=C3C4(C1N(CC4)CC5C2O5)C6=CC=CC=C6N3)C(=O)OC | 352.40 | unknown |
https://doi.org/10.1039/B301167D https://doi.org/10.1002/CHIN.200334196 https://doi.org/10.1016/0031-9422(95)00266-A |
| 12-Ethyl-8-methyl-14-oxa-8,17-diazahexacyclo[10.7.1.01,9.02,7.013,15.017,20]icosa-2,4,6-triene | 72952784 | Click to see CCC12CCC3C4(C1N(CC4)CC5C2O5)C6=CC=CC=C6N3C | 310.40 | unknown |
https://doi.org/10.1016/0031-9422(95)00266-A https://doi.org/10.1002/CHIN.200334196 https://doi.org/10.1021/NP060344O https://doi.org/10.1515/ZNB-1983-1227 https://doi.org/10.1039/B301167D |
| Aspidospermine | 227613 | Click to see | 354.50 | unknown | https://doi.org/10.1021/NP50078A010 |
| Conophyllidine | 44566831 | Click to see CCC12CC(=C3C4(C1N(CC4)CC=C2)C5=C(N3)C=C6C(=C5)C7C(O6)C(C8(CC(=C9C1(C8N7CC1)C1=CC(=C(C(=C1N9)OC)OC)O)C(=O)OC)CC)O)C(=O)OC | 778.90 | unknown | https://doi.org/10.1021/NP50101A001 |
| Conophyllinine | 10887328 | Click to see CCC12CC(=C3C4(C1N(CC4)CC(C2O)O)C5=C(N3)C=C6C(=C5)C7C(O6)C(C8(CC(=C9C1(C8N7CC1)C1=CC(=C(C(=C1N9)OC)OC)O)C(=O)OC)CC)O)C(=O)OC | 812.90 | unknown |
https://doi.org/10.1002/CHIN.200334196 https://doi.org/10.1039/B301167D |
| dimethyl (2R,6R,11R,13S,23S,24S,25S,36R,39R,40R)-14,25-diethyl-24,33-dihydroxy-31,32-dimethoxy-12,22-dioxa-1,9,18,29-tetrazadodecacyclo[23.13.1.16,9.02,23.03,21.05,19.06,17.011,13.028,36.030,35.036,39.014,40]tetraconta-3,5(19),16,20,27,30,32,34-octaene-16,27-dicarboxylate | 129651094 | Click to see | 794.90 | unknown |
https://doi.org/10.1021/NP50101A001 https://doi.org/10.1016/S0040-4039(00)91590-9 https://doi.org/10.1016/0031-9422(95)00266-A https://doi.org/10.1002/CHIN.200334196 |
| Dimethyl 13,24-diethyl-11,12,23,32-tetrahydroxy-30,31-dimethoxy-21-oxa-1,9,17,28-tetrazaundecacyclo[22.13.1.16,9.02,22.03,20.05,18.06,16.027,35.029,34.035,38.013,39]nonatriaconta-3,5(18),15,19,26,29,31,33-octaene-15,26-dicarboxylate | 85303244 | Click to see | 812.90 | unknown | https://doi.org/10.1039/B301167D |
| Dimethyl 14,25-diethyl-24,33-dihydroxy-31,32-dimethoxy-12,22-dioxa-1,9,18,29-tetrazadodecacyclo[23.13.1.16,9.02,23.03,21.05,19.06,17.011,13.028,36.030,35.036,39.014,40]tetraconta-3,5(19),16,20,27,30,32,34-octaene-16,27-dicarboxylate | 9853848 | Click to see | 794.90 | unknown |
https://doi.org/10.1016/0031-9422(95)00266-A https://doi.org/10.1039/B301167D |
| Lochnericine | 11382599 | Click to see CCC12CC(=C3C4(C1N(CC4)CC5C2O5)C6=CC=CC=C6N3)C(=O)OC | 352.40 | unknown | https://doi.org/10.1016/0031-9422(75)85375-1 |
| methyl (1R,12S,13S,15R,16R,20R)-12-ethyl-16-[(1R,9S,12S,13S,14S,19R)-12-ethyl-13,14-dihydroxy-8-methyl-8,16-diazapentacyclo[10.6.1.01,9.02,7.016,19]nonadeca-2(7),3,5-trien-4-yl]-4-hydroxy-5,6-dimethoxy-14-oxa-8,17-diazahexacyclo[10.7.1.01,9.02,7.013,15.017,20]icosa-2,4,6,9-tetraene-10-carboxylate | 101931861 | Click to see | 754.90 | unknown | https://doi.org/10.1002/CHIN.200334196 |
| methyl (1R,12S,13S,15R,16R,20R)-12-ethyl-16-[(1S,9R,12S,13S,15R,20R)-12-ethyl-8-methyl-14-oxa-8,17-diazahexacyclo[10.7.1.01,9.02,7.013,15.017,20]icosa-2(7),3,5-trien-4-yl]-4-hydroxy-5,6-dimethoxy-14-oxa-8,17-diazahexacyclo[10.7.1.01,9.02,7.013,15.017,20]icosa-2,4,6,9-tetraene-10-carboxylate | 162937449 | Click to see | 736.90 | unknown | https://doi.org/10.1016/0031-9422(95)00266-A |
| methyl (1R,12S,13S,15R,16R,20R)-12-ethyl-16-[(1S,9S,12S,13S,14S,19R)-12-ethyl-13,14-dihydroxy-8-methyl-8,16-diazapentacyclo[10.6.1.01,9.02,7.016,19]nonadeca-2(7),3,5-trien-4-yl]-4-hydroxy-5,6-dimethoxy-14-oxa-8,17-diazahexacyclo[10.7.1.01,9.02,7.013,15.017,20]icosa-2,4,6,9-tetraene-10-carboxylate | 15215006 | Click to see | 754.90 | unknown | https://doi.org/10.1039/B301167D |
| methyl (1R,12S,13S,15R,20R)-12-ethyl-14-oxa-8,17-diazahexacyclo[10.7.1.01,9.02,7.013,15.017,20]icosa-2,4,6,9-tetraene-10-carboxylate | 21586675 | Click to see | 352.40 | unknown |
https://doi.org/10.1016/0031-9422(95)00266-A https://doi.org/10.1039/B301167D |
| methyl (1R,12S,13S,15R,20R)-12-ethyl-4-hydroxy-5,6-dimethoxy-14-oxa-8,17-diazahexacyclo[10.7.1.01,9.02,7.013,15.017,20]icosa-2,4,6,9-tetraene-10-carboxylate | 11761758 | Click to see CCC12CC(=C3C4(C1N(CC4)CC5C2O5)C6=CC(=C(C(=C6N3)OC)OC)O)C(=O)OC | 428.50 | unknown | https://doi.org/10.1039/B301167D |
| Methyl 12-ethyl-16-(12-ethyl-13,14-dihydroxy-8-methyl-8,16-diazapentacyclo[10.6.1.01,9.02,7.016,19]nonadeca-2(7),3,5-trien-4-yl)-4-hydroxy-5,6-dimethoxy-14-oxa-8,17-diazahexacyclo[10.7.1.01,9.02,7.013,15.017,20]icosa-2,4,6,9-tetraene-10-carboxylate | 162970771 | Click to see | 754.90 | unknown | https://doi.org/10.1039/B301167D |
| Methyl 12-ethyl-16-(12-ethyl-8-methyl-14-oxa-8,17-diazahexacyclo[10.7.1.01,9.02,7.013,15.017,20]icosa-2(7),3,5-trien-4-yl)-4-hydroxy-5,6-dimethoxy-14-oxa-8,17-diazahexacyclo[10.7.1.01,9.02,7.013,15.017,20]icosa-2,4,6,9-tetraene-10-carboxylate | 85043184 | Click to see | 736.90 | unknown |
https://doi.org/10.1016/0031-9422(95)00266-A https://doi.org/10.1039/B301167D |
| Methyl 12-ethyl-4-hydroxy-5,6-dimethoxy-14-oxa-8,17-diazahexacyclo[10.7.1.01,9.02,7.013,15.017,20]icosa-2,4,6,9-tetraene-10-carboxylate | 73089926 | Click to see | 428.50 | unknown | https://doi.org/10.1039/B301167D |
| > Alkaloids and derivatives / Corynanthean-type alkaloids | |||||
| Isositsirikine | 6436828 | Click to see CC=C1CN2CCC3=C(C2CC1C(CO)C(=O)OC)NC4=CC=CC=C34 | 354.40 | unknown | https://doi.org/10.1039/B301167D |
| methyl 2-[(3E)-3-ethylidene-2,4,6,7,12,12b-hexahydro-1H-indolo[2,3-a]quinolizin-2-yl]-3-hydroxypropanoate | 5318674 | Click to see CC=C1CN2CCC3=C(C2CC1C(CO)C(=O)OC)NC4=CC=CC=C34 | 354.40 | unknown | https://doi.org/10.1039/B301167D |
| > Alkaloids and derivatives / Ervatamia alkaloids | |||||
| 19,20-Didehydroervatamine | 14707491 | Click to see CC=C1CN(CC2(C1CC(=O)C3=C(C2)C4=CC=CC=C4N3)C(=O)OC)C | 352.40 | unknown | https://doi.org/10.1021/NP060344O |
| 20-epi-Evatamine | 12308875 | Click to see CCC1CN(CC2(C1CC(=O)C3=C(C2)C4=CC=CC=C4N3)C(=O)OC)C | 354.40 | unknown | https://doi.org/10.1021/NP060344O |
| Ervatamine | 161765 | Click to see CCC1CN(CC2(C1CC(=O)C3=C(C2)C4=CC=CC=C4N3)C(=O)OC)C | 354.40 | unknown | https://doi.org/10.1021/NP060344O |
| > Alkaloids and derivatives / Ibogan-type alkaloids | |||||
| (-)-20S-Heyneanine | 432336 | Click to see CC(C1CC2CC3(C1N(C2)CCC4=C3NC5=CC=CC=C45)C(=O)OC)O | 354.40 | unknown | https://doi.org/10.1590/1809-43921983132409 |
| (1R,15S,17S)-17-ethyl-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4,6,8-tetraene | 51055165 | Click to see | 280.40 | unknown |
https://doi.org/10.1002/CHIN.200334196 https://doi.org/10.1021/NP060344O https://doi.org/10.1021/NP50078A010 |
| (1R,15S)-17-ethyl-7-methoxy-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4(9),5,7-tetraene | 89578867 | Click to see CCC1CC2CC3C1N(C2)CCC4=C3NC5=C4C=C(C=C5)OC | 310.40 | unknown | https://doi.org/10.1002/CHIN.200334196 |
| (1S)-1-[(1R,15R,17R,18R)-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4,6,8-tetraen-17-yl]ethanol | 44566758 | Click to see | 296.40 | unknown | https://doi.org/10.1016/0378-8741(95)01328-8 |
| 1-[(1R,14R,15S,17S,18S)-17-ethyl-7-methoxy-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4(9),5,7-tetraen-14-yl]propan-2-one | 72191029 | Click to see | 366.50 | unknown | https://doi.org/10.1021/NP400130Y |
| 10-Methoxycoronaridine | 10361692 | Click to see | 368.50 | unknown |
https://doi.org/10.1016/0031-9422(75)85375-1 https://doi.org/10.1021/NP060344O https://doi.org/10.1039/B301167D https://doi.org/10.1021/NP50057A012 |
| 12-Methoxyibogamine | 442108 | Click to see | 310.40 | unknown | https://doi.org/10.1002/CHIN.200334196 |
| 13-Methoxy-14-[(3R)-17-methoxy-17-oxovobasan-3alpha-yl]ibogamine-18-carboxylic acid methyl ester | 431073 | Click to see | 704.90 | unknown | https://doi.org/10.1016/0378-8741(95)01328-8 |
| 19-Epivoacristine | 56842093 | Click to see | 384.50 | unknown | https://doi.org/10.1021/NP50101A001 |
| 19,20-Dihydrotabernamine | 44418787 | Click to see CCC1CC2CC3C1N(C2)CCC4=C3NC5=C4C=CC(=C5)C6CC7C(CN(C(C7C(=O)OC)CC8=C6NC9=CC=CC=C89)C)CC | 618.80 | unknown | https://doi.org/10.1021/NP060344O |
| 6,9-Methano-5H-pyrido[1',2':1,2]azepino[4,5-b]indole, 7-ethyl-6,6a,7,8,9,10,12,13-octahydro-, [6R-(6alpha,6abeta,7beta,9alpha)]- | 500053 | Click to see CCC1CC2CC3C1N(C2)CCC4=C3NC5=CC=CC=C45 | 280.40 | unknown |
https://doi.org/10.1002/CHIN.200334196 https://doi.org/10.1021/NP060344O https://doi.org/10.1021/NP50078A010 https://doi.org/10.1039/B301167D |
| CID 3582412 | 3582412 | Click to see | 384.50 | unknown | https://doi.org/10.1039/B301167D |
| Coronardine | 278173 | Click to see CCC1CC2CC3(C1N(C2)CCC4=C3NC5=CC=CC=C45)C(=O)OC | 338.40 | unknown |
https://doi.org/10.1590/1809-43921983132409 https://doi.org/10.1016/0031-9422(74)80344-4 |
| Coronaridine | 73489 | Click to see | 338.40 | unknown |
https://doi.org/10.1021/NP060344O https://doi.org/10.1016/0031-9422(74)80344-4 https://doi.org/10.1021/NP50078A010 https://doi.org/10.1590/1809-43921983132409 https://doi.org/10.1007/BF00270178 https://doi.org/10.1021/NP50057A012 https://doi.org/10.1016/0378-8741(95)01328-8 https://doi.org/10.1016/0031-9422(91)84254-P https://doi.org/10.1016/J.BMCL.2015.07.036 |
| Coronaridine Hydroxyindolenine | 14061706 | Click to see | 354.40 | unknown | https://doi.org/10.1016/J.BMCL.2015.07.036 |
| Ervadivaricatine B | 44418786 | Click to see | 706.90 | unknown | https://doi.org/10.1021/NP060344O |
| Heyneanine hydroxy-indolenine | 157416 | Click to see | 370.40 | unknown | https://doi.org/10.1021/NP50057A012 |
| Ibogaine | 197060 | Click to see CCC1CC2CC3C1N(C2)CCC4=C3NC5=C4C=C(C=C5)OC | 310.40 | unknown | https://doi.org/10.1039/B301167D |
| Ibogaline | 193302 | Click to see | 340.50 | unknown | https://doi.org/10.1021/NP50078A010 |
| Ibogamine | 100217 | Click to see | 280.40 | unknown |
https://doi.org/10.1021/NP060344O https://doi.org/10.1039/B301167D |
| Ibogamine-18-carboxylic acid, 12-methoxy-, methyl ester | 363270 | Click to see CCC1CC2CC3(C1N(C2)CCC4=C3NC5=C4C=C(C=C5)OC)C(=O)OC | 368.50 | unknown |
https://doi.org/10.1039/B301167D https://doi.org/10.1021/NP50078A010 https://doi.org/10.1590/1809-43921983132409 https://doi.org/10.1021/NP50057A012 https://doi.org/10.1002/CHIN.200334196 https://doi.org/10.19540/J.CNKI.CJCMM.20180115.007 https://doi.org/10.1016/0031-9422(91)84254-P https://doi.org/10.1016/J.BMCL.2015.07.036 https://doi.org/10.1021/NP50101A001 |
| Ibogamine, 12-methoxy- | 363272 | Click to see CCC1CC2CC3C1N(C2)CCC4=C3NC5=C4C=C(C=C5)OC | 310.40 | unknown | https://doi.org/10.1039/B301167D |
| Isovoacangine | 44393473 | Click to see | 368.50 | unknown |
https://doi.org/10.1016/J.BMCL.2015.07.036 https://doi.org/10.1016/0031-9422(91)84254-P |
| methyl (15S,17S)-17-ethyl-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4,6,8-tetraene-1-carboxylate | 137628478 | Click to see | 338.40 | unknown |
https://doi.org/10.1021/NP50078A010 https://doi.org/10.1007/BF00270178 https://doi.org/10.1021/NP50057A012 https://doi.org/10.1016/0378-8741(95)01328-8 https://doi.org/10.1016/0031-9422(91)84254-P |
| methyl (1R,12S,14R,15S,18S)-15-ethyl-12-[(1R,15R,17S,18S)-17-ethyl-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4(9),5,7-tetraen-5-yl]-17-methyl-10,17-diazatetracyclo[12.3.1.03,11.04,9]octadeca-3(11),4,6,8-tetraene-18-carboxylate | 163106399 | Click to see CCC1CC2CC3C1N(C2)CCC4=C3NC5=C4C=CC=C5C6CC7C(CN(C(C7C(=O)OC)CC8=C6NC9=CC=CC=C89)C)CC | 618.80 | unknown | https://doi.org/10.1021/NP060344O |
| methyl (1R,15R,17S,18S)-17-ethyl-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4,6,8-tetraene-1-carboxylate | 11186794 | Click to see | 338.40 | unknown | via CMAUP database |
| Methyl (1R,15R)-17-ethyl-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4,6,8,16-pentaene-1-carboxylate | 13993928 | Click to see CCC1=CC2CC3(C1N(C2)CCC4=C3NC5=CC=CC=C45)C(=O)OC | 336.40 | unknown | https://doi.org/10.1007/BF00270178 |
| methyl (1R,15S,17R,18S)-17-ethyl-7-methoxy-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4(9),5,7-tetraene-1-carboxylate | 134688048 | Click to see CCC1CC2CC3(C1N(C2)CCC4=C3NC5=C4C=C(C=C5)OC)C(=O)OC | 368.50 | unknown |
https://doi.org/10.1021/NP50078A010 https://doi.org/10.1021/NP50057A012 https://doi.org/10.1002/CHIN.200334196 https://doi.org/10.1016/0031-9422(91)84254-P https://doi.org/10.1021/NP060344O https://doi.org/10.1021/NP50101A001 |
| methyl (1S,10R,15R,17S,18S)-10-hydroxy-17-[(1S)-1-hydroxyethyl]-7-methoxy-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2,4(9),5,7-tetraene-1-carboxylate | 162989056 | Click to see | 400.50 | unknown | https://doi.org/10.1021/NP50057A012 |
| methyl (1S,10R,15R,17S,18S)-17-ethyl-10-hydroxy-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2,4,6,8-tetraene-1-carboxylate | 154496378 | Click to see | 354.40 | unknown |
https://doi.org/10.1021/NP060344O https://doi.org/10.1016/0031-9422(80)83085-8 https://doi.org/10.1021/NP50057A012 |
| methyl (1S,10R,15R,17S,18S)-17-ethyl-10-hydroxy-7-methoxy-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2,4(9),5,7-tetraene-1-carboxylate | 21604116 | Click to see | 384.50 | unknown |
https://doi.org/10.1021/NP060344O https://doi.org/10.1021/NP50057A012 |
| methyl (1S,12S,15R,17S,18S)-17-ethyl-12-hydroxy-11-oxo-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4,6,8-tetraene-1-carboxylate | 162821401 | Click to see CCC1CC2CC3(C1N(C2)C(C(=O)C4=C3NC5=CC=CC=C54)O)C(=O)OC | 368.40 | unknown | https://doi.org/10.1016/0031-9422(80)83085-8 |
| methyl (1S,15R,17R,18S)-17-[(1S)-1-hydroxyethyl]-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4,6,8-tetraene-1-carboxylate | 102067253 | Click to see CC(C1CC2CC3(C1N(C2)CCC4=C3NC5=CC=CC=C45)C(=O)OC)O | 354.40 | unknown | https://doi.org/10.1021/NP50057A012 |
| methyl (1S,15R,17R,18S)-17-ethyl-16-oxo-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4,6,8-tetraene-1-carboxylate | 102121234 | Click to see CCC1C2C3(CC(C1=O)CN2CCC4=C3NC5=CC=CC=C45)C(=O)OC | 352.40 | unknown | https://doi.org/10.1021/NP50057A012 |
| methyl (1S,15R,17S,18S)-17-[(1S)-1-hydroxyethyl]-6-methoxy-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4(9),5,7-tetraene-1-carboxylate | 101243095 | Click to see CC(C1CC2CC3(C1N(C2)CCC4=C3NC5=C4C=CC(=C5)OC)C(=O)OC)O | 384.50 | unknown | https://doi.org/10.1016/0031-9422(91)84254-P |
| methyl (1S,15R,17S,18S)-17-ethyl-11-oxo-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4,6,8-tetraene-1-carboxylate | 163067417 | Click to see | 352.40 | unknown | https://doi.org/10.1016/0031-9422(80)83085-8 |
| methyl (1S,15R,17S,18S)-17-ethyl-12-oxo-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4,6,8-tetraene-1-carboxylate | 162908468 | Click to see | 352.40 | unknown | https://doi.org/10.1016/0031-9422(80)83085-8 |
| methyl (1S,15R,17S,18S)-17-ethyl-14-oxo-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4,6,8-tetraene-1-carboxylate | 131878933 | Click to see | 352.40 | unknown | https://doi.org/10.1021/NP50057A012 |
| methyl (1S,15R,17S,18S)-17-ethyl-6-[(1R,15E,18S)-15-ethylidene-18-methoxycarbonyl-17-methyl-10,17-diazatetracyclo[12.3.1.03,11.04,9]octadeca-3(11),4,6,8-tetraen-12-yl]-7-methoxy-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4,6,8-tetraene-1-carboxylate | 137628555 | Click to see CCC1CC2CC3(C1N(C2)CCC4=C3NC5=CC(=C(C=C45)OC)C6CC7C(C(CC8=C6NC9=CC=CC=C89)N(CC7=CC)C)C(=O)OC)C(=O)OC | 704.90 | unknown | https://doi.org/10.1016/0378-8741(95)01328-8 |
| methyl (1S,15R,17S,18S)-17-ethyl-6-[(1S,12S,14R,15R,18S)-15-ethyl-18-methoxycarbonyl-17-methyl-10,17-diazatetracyclo[12.3.1.03,11.04,9]octadeca-3(11),4,6,8-tetraen-12-yl]-7-methoxy-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4,6,8-tetraene-1-carboxylate | 162914844 | Click to see | 706.90 | unknown | https://doi.org/10.1021/NP060344O |
| methyl (1S,15R,17S,18S)-17-ethyl-6-[(1S,12S,14R,15S,18S)-15-ethyl-18-methoxycarbonyl-17-methyl-10,17-diazatetracyclo[12.3.1.03,11.04,9]octadeca-3(11),4,6,8-tetraen-12-yl]-7-methoxy-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4,6,8-tetraene-1-carboxylate | 161866834 | Click to see CCC1CC2CC3(C1N(C2)CCC4=C3NC5=CC(=C(C=C45)OC)C6CC7C(CN(C(C7C(=O)OC)CC8=C6NC9=CC=CC=C89)C)CC)C(=O)OC | 706.90 | unknown | https://doi.org/10.1021/NP060344O |
| methyl (1S,15R,17S,18S)-17-ethyl-7-methoxy-14-oxo-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4(9),5,7-tetraene-1-carboxylate | 12110672 | Click to see | 382.50 | unknown | https://doi.org/10.1021/NP50057A012 |
| methyl (1S,17S,18S)-17-[(1S)-1-hydroxyethyl]-7-methoxy-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4(9),5,7-tetraene-1-carboxylate | 163187265 | Click to see | 384.50 | unknown |
https://doi.org/10.1016/0031-9422(75)85375-1 https://doi.org/10.1021/NP50057A012 |
| methyl (1S,17S,18S)-17-ethyl-7-methoxy-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4(9),5,7-tetraene-1-carboxylate | 163188392 | Click to see CCC1CC2CC3(C1N(C2)CCC4=C3NC5=C4C=C(C=C5)OC)C(=O)OC | 368.50 | unknown |
https://doi.org/10.1016/0031-9422(75)85375-1 https://doi.org/10.1021/NP060344O https://doi.org/10.1021/NP50057A012 |
| methyl (1S,3'R,12R,14S,15R,16S,19R)-12-[(1S,15S,17S,18S)-17-ethyl-6-methoxy-1-methoxycarbonyl-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4(9),5,7-tetraen-5-yl]-3',20-dimethylspiro[17-oxa-10,20-diazapentacyclo[14.3.1.03,11.04,9.014,19]icosa-3(11),4,6,8-tetraene-15,2'-oxirane]-19-carboxylate | 72549948 | Click to see CCC1CC2CC3(C1N(C2)CCC4=C3NC5=C4C=CC(=C5C6CC7C8(COC(C79C(O9)C)N(C8CC1=C6NC2=CC=CC=C12)C)C(=O)OC)OC)C(=O)OC | 748.90 | unknown | https://doi.org/10.1021/NP400130Y |
| Voacamine | 11953931 | Click to see CCC1CC2CC3(C1N(C2)CCC4=C3NC5=CC(=C(C=C45)OC)C6CC7C(C(CC8=C6NC9=CC=CC=C89)N(CC7=CC)C)C(=O)OC)C(=O)OC | 704.90 | unknown | https://doi.org/10.1016/0378-8741(95)01328-8 |
| Voacangarine | 196982 | Click to see | 384.50 | unknown |
https://doi.org/10.1016/0165-1218(86)90004-2 https://doi.org/10.1002/CHIN.200334196 https://doi.org/10.1016/0378-8741(95)01328-8 https://doi.org/10.1021/NP50057A012 https://doi.org/10.1039/B301167D https://doi.org/10.1016/0031-9422(75)85375-1 https://doi.org/10.1016/0031-9422(91)84254-P https://doi.org/10.1021/NP50101A001 |
| Voacangine | 73255 | Click to see CCC1CC2CC3(C1N(C2)CCC4=C3NC5=C4C=C(C=C5)OC)C(=O)OC | 368.50 | unknown | via CMAUP database |
| > Alkaloids and derivatives / Macroline alkaloids | |||||
| methyl (12R,14R)-15-ethylidene-3,17-diazapentacyclo[12.3.1.02,10.04,9.012,17]octadeca-2(10),4,6,8-tetraene-13-carboxylate | 129317237 | Click to see CC=C1CN2C3CC1C(C2CC4=C3NC5=CC=CC=C45)C(=O)OC | 322.40 | unknown | https://doi.org/10.1021/NP50078A010 |
| methyl (1S,12S,13R,14S,15R)-15-ethyl-6-methoxy-3-methyl-3,17-diazapentacyclo[12.3.1.02,10.04,9.012,17]octadeca-2(10),4(9),5,7-tetraene-13-carboxylate | 162968966 | Click to see CCC1CN2C3CC1C(C2CC4=C3N(C5=C4C=CC(=C5)OC)C)C(=O)OC | 368.50 | unknown | https://doi.org/10.1016/0031-9422(91)84254-P |
| methyl (1S,14S,15E)-15-ethylidene-3,17-diazapentacyclo[12.3.1.02,10.04,9.012,17]octadeca-2(10),4,6,8-tetraene-13-carboxylate | 6436185 | Click to see CC=C1CN2C3CC1C(C2CC4=C3NC5=CC=CC=C45)C(=O)OC | 322.40 | unknown | https://doi.org/10.1021/NP50078A010 |
| Methyl 15-ethyl-6-methoxy-3-methyl-3,17-diazapentacyclo[12.3.1.02,10.04,9.012,17]octadeca-2(10),4(9),5,7-tetraene-13-carboxylate | 14845646 | Click to see CCC1CN2C3CC1C(C2CC4=C3N(C5=C4C=CC(=C5)OC)C)C(=O)OC | 368.50 | unknown | https://doi.org/10.1016/0031-9422(91)84254-P |
| > Alkaloids and derivatives / Plumeran-type alkaloids | |||||
| Tabersonine | 20485 | Click to see CCC12CC(=C3C4(C1N(CC4)CC=C2)C5=CC=CC=C5N3)C(=O)OC | 336.40 | unknown |
https://doi.org/10.1021/NP50078A010 https://doi.org/10.1021/NP060344O |
| > Alkaloids and derivatives / Quebrachamine alkaloids | |||||
| (13R,15S,16S,18R)-15-ethyl-11-methyl-17-oxa-1,11-diazapentacyclo[13.4.1.04,12.05,10.016,18]icosa-4(12),5,7,9-tetraen-13-ol | 11759202 | Click to see | 326.40 | unknown | https://doi.org/10.1039/B301167D |
| (13R,15S,16S,18R)-15-ethyl-17-oxa-1,11-diazapentacyclo[13.4.1.04,12.05,10.016,18]icosa-4(12),5,7,9-tetraen-13-ol | 11833936 | Click to see | 312.40 | unknown |
https://doi.org/10.1002/CHIN.200334196 https://doi.org/10.1080/10575639508043210 https://doi.org/10.1039/B301167D |
| (15R,16S,17S)-15-ethyl-11-methyl-1,11-diazatetracyclo[13.3.1.04,12.05,10]nonadeca-4(12),5,7,9-tetraene-16,17-diol | 101243262 | Click to see | 328.40 | unknown |
https://doi.org/10.1080/10575639608043239 https://doi.org/10.1002/CHIN.200334196 |
| (15S,16S,18R)-15-ethyl-8-hydroxy-17-oxa-1,11-diazapentacyclo[13.4.1.04,12.05,10.016,18]icosa-4(12),5(10),6,8-tetraen-2-one | 163103554 | Click to see | 326.40 | unknown | https://doi.org/10.1016/S0031-9422(00)83077-0 |
| (1aR,13S,13aS)-13-Ethyl-1a,4,5,10,11,12,13,13a-octahydro-10-methyl-2H-3,13-methanooxireno[9,10]azacycloundecino[5,4-b]indole | 72961635 | Click to see | 310.40 | unknown | https://doi.org/10.1039/B301167D |
| (1R,17S,18R)-17-ethoxy-19-oxa-5,15-diazapentacyclo[13.6.1.01,18.04,12.06,11]docosa-4(12),6,8,10-tetraene | 163187470 | Click to see | 340.50 | unknown | https://doi.org/10.1016/S0031-9422(00)83077-0 |
| (2R,15R,16S,18R)-15-ethyl-17-oxa-1,11-diazapentacyclo[13.4.1.04,12.05,10.016,18]icosa-4(12),5,7,9-tetraen-2-ol | 162850756 | Click to see CCC12CCC3=C(CC(N(C1)CC4C2O4)O)C5=CC=CC=C5N3 | 312.40 | unknown | https://doi.org/10.1016/S0031-9422(00)81265-0 |
| (2R,15S,16S,18R)-15-ethyl-17-oxa-1,11-diazapentacyclo[13.4.1.04,12.05,10.016,18]icosa-4(12),5,7,9-tetraen-2-ol | 163186208 | Click to see | 312.40 | unknown | https://doi.org/10.1016/S0031-9422(00)81265-0 |
| 15-Ethyl-11-methyl-1,11-diazatetracyclo[13.3.1.04,12.05,10]nonadeca-4(12),5,7,9-tetraene-16,17-diol | 85406108 | Click to see | 328.40 | unknown | https://doi.org/10.1039/B301167D |
| 15-Ethyl-11-methyl-17-oxa-1,11-diazapentacyclo[13.4.1.04,12.05,10.016,18]icosa-4(12),5,7,9-tetraen-13-ol | 73088687 | Click to see | 326.40 | unknown | https://doi.org/10.1039/B301167D |
| 15-Ethyl-17-oxa-1,11-diazapentacyclo[13.4.1.04,12.05,10.016,18]icosa-4(12),5,7,9-tetraen-13-ol | 73121893 | Click to see | 312.40 | unknown | https://doi.org/10.1039/B301167D |
| 15-Ethyl-17-oxa-1,11-diazapentacyclo[13.4.1.04,12.05,10.016,18]icosa-4(12),5,7,9-tetraen-2-ol | 162850755 | Click to see | 312.40 | unknown | https://doi.org/10.1016/S0031-9422(00)81265-0 |
| 15-Ethyl-8-hydroxy-17-oxa-1,11-diazapentacyclo[13.4.1.04,12.05,10.016,18]icosa-4(12),5(10),6,8-tetraen-2-one | 163103553 | Click to see | 326.40 | unknown | https://doi.org/10.1016/S0031-9422(00)83077-0 |
| 17-Ethoxy-19-oxa-5,15-diazapentacyclo[13.6.1.01,18.04,12.06,11]docosa-4(12),6,8,10-tetraene | 162928771 | Click to see | 340.50 | unknown |
https://doi.org/10.1016/S0031-9422(00)83077-0 https://doi.org/10.1515/ZNB-1983-1028 |
| Conoflorine | 453208 | Click to see | 296.40 | unknown | https://doi.org/10.1007/BF00270178 |
| Ervayunine | 149353 | Click to see | 296.40 | unknown |
https://doi.org/10.1016/0031-9422(95)00266-A https://doi.org/10.1039/B301167D |
| Hecubine | 11438319 | Click to see | 310.40 | unknown |
https://doi.org/10.3987/R-1985-12-2975 https://doi.org/10.1039/B301167D |
| Voafinidine | 11121012 | Click to see | 328.40 | unknown | https://doi.org/10.1039/B301167D |
| Voaphylline | 10469868 | Click to see | 296.40 | unknown |
https://doi.org/10.1055/S-2006-961445 https://doi.org/10.1007/BF00235298 https://doi.org/10.1002/CHIN.200334196 https://doi.org/10.1016/S0040-4039(00)91590-9 https://doi.org/10.1021/NP060344O https://doi.org/10.1021/NP50078A010 https://doi.org/10.1016/0031-9422(74)80344-4 https://doi.org/10.1016/S0031-9422(00)90584-3 https://doi.org/10.1039/B301167D https://doi.org/10.1016/0031-9422(95)00266-A |
| > Alkaloids and derivatives / Strychnos alkaloids | |||||
| Akuammicine | 10314057 | Click to see | 322.40 | unknown | https://doi.org/10.1021/NP060344O |
| Dihydrocondylocarpine | 100004 | Click to see | 324.40 | unknown |
https://doi.org/10.1021/NP50078A010 https://doi.org/10.1021/NP50049A013 https://doi.org/10.1007/BF00270178 |
| methyl (1R,11R,12E,17S)-12-ethylidene-8,14-diazapentacyclo[9.5.2.01,9.02,7.014,17]octadeca-2,4,6,9-tetraene-10-carboxylate | 162899063 | Click to see CC=C1CN2CCC34C2CC1C(=C3NC5=CC=CC=C45)C(=O)OC | 322.40 | unknown | https://doi.org/10.1021/NP060344O |
| methyl (1S,17R,18S)-18-ethyl-8,14-diazapentacyclo[9.5.2.01,9.02,7.014,17]octadeca-2,4,6,9-tetraene-10-carboxylate | 134716702 | Click to see | 324.40 | unknown |
https://doi.org/10.1021/NP060344O https://doi.org/10.1021/NP50078A010 https://doi.org/10.1021/NP50049A013 https://doi.org/10.1007/BF00270178 |
| methyl (3beta,19Z)-12-hydroxy-2,16-didehydrocur-19-en-17-oate | 44659056 | Click to see | 338.40 | unknown | https://doi.org/10.1007/BF00270178 |
| Methyl 12-ethylidene-8,14-diazapentacyclo[9.5.2.01,9.02,7.014,17]octadeca-2,4,6,9-tetraene-10-carboxylate | 5087855 | Click to see CC=C1CN2CCC34C2CC1C(=C3NC5=CC=CC=C45)C(=O)OC | 322.40 | unknown | https://doi.org/10.1021/NP060344O |
| Tubotaiwin | 9973540 | Click to see CCC1C2CCN3C1C4(CC3)C5=CC=CC=C5NC4=C2C(=O)OC | 324.40 | unknown | https://doi.org/10.1021/NP060344O |
| > Alkaloids and derivatives / Vallesaman alkaloids | |||||
| (12R,13R,14E)-14-ethylidene-12-methyl-1,10-diazatetracyclo[11.2.2.03,11.04,9]heptadeca-3(11),4,6,8-tetraen-12-ol | 163188308 | Click to see | 282.40 | unknown | https://doi.org/10.1039/B301167D |
| (13S,14Z)-14-ethylidene-12-methylidene-1,10-diazatetracyclo[11.2.2.03,11.04,9]heptadeca-3(11),4,6,8-tetraene | 6447828 | Click to see | 264.40 | unknown | https://doi.org/10.1016/0031-9422(95)00266-A |
| 14-Ethylidene-12-methyl-1,10-diazatetracyclo[11.2.2.03,11.04,9]heptadeca-3(11),4,6,8-tetraen-12-ol | 599027 | Click to see | 282.40 | unknown | https://doi.org/10.1039/B301167D |
| 14-Ethylidene-12-methylidene-1,10-diazatetracyclo[11.2.2.03,11.04,9]heptadeca-3(11),4,6,8-tetraene | 257530 | Click to see | 264.40 | unknown |
https://doi.org/10.1016/0031-9422(95)00266-A https://doi.org/10.1039/B301167D |
| CID 6912322 | 6912322 | Click to see CC=C1CN2CCC1C(=C)C3=C(C2)C4=CC=CC=C4N3 | 264.40 | unknown |
https://doi.org/10.1002/CHIN.200334196 https://doi.org/10.1021/NP060344O https://doi.org/10.1021/NP50078A010 https://doi.org/10.1039/B301167D https://doi.org/10.1016/0031-9422(95)00266-A https://doi.org/10.1021/NP50101A001 |
| methyl (12R,13S,14Z)-12-(acetyloxymethyl)-14-ethylidene-1,10-diazatetracyclo[11.2.2.03,11.04,9]heptadeca-3(11),4,6,8-tetraene-12-carboxylate | 101287841 | Click to see | 382.50 | unknown |
https://doi.org/10.1016/S0031-9422(00)94989-6 https://doi.org/10.1021/NP50078A010 https://doi.org/10.1007/BF00235298 https://doi.org/10.1016/S0031-9422(00)90584-3 https://doi.org/10.1055/S-2006-961606 https://doi.org/10.1055/S-2006-961445 |
| > Alkaloids and derivatives / Vobasan alkaloids | |||||
| (-)-Dregamine | 99108 | Click to see | 354.40 | unknown | https://doi.org/10.1021/NP060344O |
| methyl (15S)-15-ethyl-12-[16-ethyl-8-methoxy-18-(2-methoxy-2-oxoethyl)-2,12-diazapentacyclo[15.1.1.02,15.05,13.06,11]nonadeca-5(13),6,8,10-tetraen-9-yl]-17-methyl-10,17-diazatetracyclo[12.3.1.03,11.04,9]octadeca-3(11),4,6,8-tetraene-18-carboxylate | 5317192 | Click to see | 720.90 | unknown | https://doi.org/10.1021/NP060344O |
| methyl (1R,14R,15R,18S)-15-ethyl-17-methyl-12-oxo-10,17-diazatetracyclo[12.3.1.03,11.04,9]octadeca-3(11),4,6,8-tetraene-18-carboxylate | 53298708 | Click to see CCC1CN(C2CC3=C(C(=O)CC1C2C(=O)OC)NC4=CC=CC=C34)C | 354.40 | unknown |
https://doi.org/10.1021/NP060344O https://doi.org/10.3987/R-1985-12-2975 https://doi.org/10.1016/0031-9422(75)85375-1 |
| methyl (1S,12R,14R,15E,18S)-15-ethylidene-12-[(13R,14E)-14-ethylidene-12-methylidene-1,10-diazatetracyclo[11.2.2.03,11.04,9]heptadeca-3(11),4(9),5,7-tetraen-6-yl]-17-methyl-10,17-diazatetracyclo[12.3.1.03,11.04,9]octadeca-3(11),4,6,8-tetraene-18-carboxylate | 102146725 | Click to see | 600.80 | unknown | https://doi.org/10.1055/S-2007-969482 |
| methyl (1S,14R,15Z,18S)-15-ethylidene-17-methyl-12-oxo-10,17-diazatetracyclo[12.3.1.03,11.04,9]octadeca-3(11),4,6,8-tetraene-18-carboxylate | 101281359 | Click to see CC=C1CN(C2CC3=C(C(=O)CC1C2C(=O)OC)NC4=CC=CC=C34)C | 352.40 | unknown |
https://doi.org/10.1021/NP50078A010 https://doi.org/10.1016/0031-9422(91)84254-P |
| methyl (1S,14S,15S)-15-ethyl-17-methyl-12-oxo-10,17-diazatetracyclo[12.3.1.03,11.04,9]octadeca-3(11),4,6,8-tetraene-18-carboxylate | 20056338 | Click to see CCC1CN(C2CC3=C(C(=O)CC1C2C(=O)OC)NC4=CC=CC=C34)C | 354.40 | unknown | https://doi.org/10.1021/NP060344O |
| Methyl 15-ethyl-12-[16-ethyl-8-methoxy-18-(2-methoxy-2-oxoethyl)-2,12-diazapentacyclo[15.1.1.02,15.05,13.06,11]nonadeca-5(13),6,8,10-tetraen-9-yl]-17-methyl-10,17-diazatetracyclo[12.3.1.03,11.04,9]octadeca-3(11),4,6,8-tetraene-18-carboxylate | 5317191 | Click to see | 720.90 | unknown | https://doi.org/10.1021/NP060344O |
| Perivine | 6473766 | Click to see CC=C1CNC2CC3=C(C(=O)CC1C2C(=O)OC)NC4=CC=CC=C34 | 338.40 | unknown | https://doi.org/10.1021/NP50078A010 |
| Tabernaemontanine | 45268651 | Click to see | 354.40 | unknown |
https://doi.org/10.1021/NP060344O https://doi.org/10.1021/JA01490A031 https://doi.org/10.1016/0031-9422(91)84254-P |
| > Alkaloids and derivatives / Yohimbine alkaloids | |||||
| (1R,10S,12R,13R,16R,17S)-16-methyl-15-oxa-8,19-diazahexacyclo[11.8.0.01,9.02,7.010,19.012,17]henicosa-2,4,6,8-tetraene | 162939603 | Click to see CC1C2CN3CCC45C(C2CC3C4=NC6=CC=CC=C56)CO1 | 294.40 | unknown | https://doi.org/10.1021/NP50035A031 |
| 16-Methyl-15-oxa-8,19-diazahexacyclo[11.8.0.01,9.02,7.010,19.012,17]henicosa-2,4,6,8-tetraene | 162939602 | Click to see | 294.40 | unknown |
https://doi.org/10.1021/NP50035A031 https://doi.org/10.1515/ZNB-1984-0925 |
| Ajmalicine | 441975 | Click to see | 352.40 | unknown | https://doi.org/10.1021/NP50078A010 |
| > Benzenoids / Benzene and substituted derivatives / Benzazocines | |||||
| Pericalline | 6436240 | Click to see | 264.40 | unknown |
https://doi.org/10.1021/NP50035A031 https://doi.org/10.1021/NP060344O https://doi.org/10.1007/BF00270178 |
| > Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Benzoic acids | |||||
| Benzoic Acid | 243 | Click to see | 122.12 | unknown | https://doi.org/10.1016/0031-9422(80)83085-8 |
| > Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Hydroxybenzoic acid derivatives | |||||
| 2,5-Dihydroxybenzoic acid | 3469 | Click to see | 154.12 | unknown | https://doi.org/10.1016/0378-8741(95)01328-8 |
| 4-Hydroxybenzoic acid | 135 | Click to see C1=CC(=CC=C1C(=O)O)O | 138.12 | unknown | https://doi.org/10.1016/0378-8741(95)01328-8 |
| > Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Hydroxybenzoic acid derivatives / Gallic acid and derivatives | |||||
| Syringic Acid | 10742 | Click to see | 198.17 | unknown | https://doi.org/10.1016/0378-8741(95)01328-8 |
| > Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Methoxybenzoic acids and derivatives / M-methoxybenzoic acids and derivatives | |||||
| Vanillic Acid | 8468 | Click to see COC1=C(C=CC(=C1)C(=O)O)O | 168.15 | unknown | https://doi.org/10.1016/0378-8741(95)01328-8 |
| > Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Salicylic acid and derivatives / Salicylic acids | |||||
| Salicylic Acid | 338 | Click to see | 138.12 | unknown | https://doi.org/10.1016/0378-8741(95)01328-8 |
| > Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / p-Hydroxybenzoic acid esters / p-Hydroxybenzoic acid alkyl esters | |||||
| Methylparaben | 7456 | Click to see | 152.15 | unknown | via CMAUP database |
| > Benzenoids / Phenols / Methoxyphenols | |||||
| Coniferyl Alcohol | 1549095 | Click to see | 180.20 | unknown | https://doi.org/10.1021/NP50078A010 |
| Sinapyl alcohol | 5280507 | Click to see COC1=CC(=CC(=C1O)OC)C=CCO | 210.23 | unknown | https://doi.org/10.1021/NP50078A010 |
| > Benzenoids / Tetralins | |||||
| 7-ethenyl-7-methyl-6-prop-1-en-2-yl-6,8-dihydro-5H-naphthalene-1,4-diol | 71439030 | Click to see | 244.33 | unknown |
https://doi.org/10.1016/0031-9422(95)00266-A https://doi.org/10.1002/CHIN.200334196 https://doi.org/10.1039/B301167D |
| > Lignans, neolignans and related compounds | |||||
| (1R)-20,21,25-trimethoxy-8,23-dioxa-15,30-diazaheptacyclo[22.6.2.29,12.13,7.114,18.027,31.022,33]hexatriaconta-3(36),4,6,9(35),10,12(34),14,18,20,22(33),24,26,31-tridecaen-6-ol | 10053935 | Click to see | 578.70 | unknown | via CMAUP database |
| 20,21,25-Trimethoxy-8,23-dioxa-15,30-diazaheptacyclo[22.6.2.29,12.13,7.114,18.027,31.022,33]hexatriaconta-1(30),3(36),4,6,9(35),10,12(34),14,18,20,22(33),24,26,31-tetradecaen-6-ol | 10325829 | Click to see | 576.60 | unknown | via CMAUP database |
| 20,25-Dimethoxy-8,23-dioxa-15,30-diazaheptacyclo[22.6.2.29,12.13,7.114,18.027,31.022,33]hexatriaconta-1(30),3(36),4,6,9(35),10,12(34),14,18,20,22(33),24,26,31-tetradecaene-6,21-diol | 10099391 | Click to see | 562.60 | unknown | via CMAUP database |
| 7R,8S-Guaiacylglycerol-8-O-4'-(Coniferyl Alcohol)Ether | 14274760 | Click to see | 376.40 | unknown | via CMAUP database |
| erythro-Guaiacylglycerol beta-dihydroconiferyl ether | 13893597 | Click to see | 378.40 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Fatty Acyls / Fatty acids and conjugates / Long-chain fatty acids | |||||
| Eicosanoic Acid | 10467 | Click to see | 312.50 | unknown | via CMAUP database |
| Stearic Acid | 5281 | Click to see | 284.50 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Fatty Acyls / Fatty acids and conjugates / Medium-chain fatty acids | |||||
| Azelaic Acid | 2266 | Click to see C(CCCC(=O)O)CCCC(=O)O | 188.22 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Prenol lipids / Diterpenoids | |||||
| Tocopherol quinone | 2734086 | Click to see | 446.70 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Prenol lipids / Diterpenoids / Colensane and clerodane diterpenoids | |||||
| Coronarin A | 24851535 | Click to see | 300.40 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Bicyclic monoterpenoids | |||||
| (3aR,4S,7S,7aS)-1,6-dihexadecyl-2,7-bis(methoxycarbonyl)-3-oxo-3a,4,7,7a-tetrahydroindene-4-carboxylic acid | 162980383 | Click to see | 743.10 | unknown | https://doi.org/10.1016/J.BMCL.2015.07.036 |
| > Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Elemane sesquiterpenoids | |||||
| (1S)-4alpha-Ethenyl-2alpha-hydroxy-3beta-[1-(hydroxymethyl)ethenyl]-6alpha-[[2-(hydroxymethyl)-1-oxo-2-propenyl]oxy | 13891365 | Click to see CC1(CC(C(C(C1C(=C)CO)O)C(=C)C(=O)OC)OC(=O)C(=C)CO)C=C | 380.40 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Prenol lipids / Terpene glycosides | |||||
| Strictosidine | 161336 | Click to see | 530.60 | unknown |
https://doi.org/10.1016/0031-9422(95)00830-6 https://doi.org/10.1016/0031-9422(94)00847-M |
| > Lipids and lipid-like molecules / Prenol lipids / Terpene glycosides / Iridoid O-glycosides | |||||
| (-)-Loganin | 87691 | Click to see | 390.40 | unknown | https://doi.org/10.1055/S-2006-957879 |
| > Lipids and lipid-like molecules / Prenol lipids / Terpene lactones / Sesquiterpene lactones | |||||
| Hemistepsin | 10043230 | Click to see | 346.40 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Prenol lipids / Terpene lactones / Sesquiterpene lactones / Germacranolides and derivatives | |||||
| [(3aS,4S,5E,9Z,11aR)-6-formyl-10-methyl-3-methylidene-2-oxo-3a,4,7,8,11,11a-hexahydrocyclodeca[b]furan-4-yl] 2-(hydroxymethyl)prop-2-enoate | 53494931 | Click to see | 346.40 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Prenol lipids / Terpene lactones / Sesquiterpene lactones / Guaianolides and derivatives | |||||
| (3S,3aR,4S,6aR,8S,9aR,9bR)-4,8-dihydroxy-3-methyl-6,9-dimethylidene-3a,4,5,6a,7,8,9a,9b-octahydro-3H-azuleno[4,5-b]furan-2-one | 12047617 | Click to see | 264.32 | unknown | via CMAUP database |
| [(3S,3aR,4S,6aR,8S,9aR,9bR)-8-hydroxy-3-methyl-6,9-dimethylidene-2-oxo-3a,4,5,6a,7,8,9a,9b-octahydro-3H-azuleno[4,5-b]furan-4-yl] 2-(hydroxymethyl)prop-2-enoate | 71503391 | Click to see CC1C2C(CC(=C)C3CC(C(=C)C3C2OC1=O)O)OC(=O)C(=C)CO | 348.40 | unknown | via CMAUP database |
| Cynaropicrin | 119093 | Click to see | 346.40 | unknown | via CMAUP database |
| Desacylcynaropicrin | 13943205 | Click to see | 262.30 | unknown | via CMAUP database |
| Isolipidiol | 14589530 | Click to see CC1C(CC2C1C3C(C(C(=O)O3)C)C(CC2=C)O)O | 266.33 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Prenol lipids / Tetraterpenoids / Carotenoids / Xanthophylls | |||||
| (1R)-4-[(1E,3E,5E,7E,9E,11E,13E,15E)-18-[(1R,4R)-4-hydroxy-2,6,6-trimethylcyclohex-2-en-1-yl]-3,7,12,16-tetramethyloctadeca-1,3,5,7,9,11,13,15-octaenyl]-3,5,5-trimethylcyclohex-3-en-1-ol | 21773685 | Click to see | 570.90 | unknown | via CMAUP database |
| (2Z,4E,6E,8E,10E,12E,14E,16E)-17-[(4R)-4-hydroxy-2,6,6-trimethylcyclohexen-1-yl]-6,11,15-trimethyl-2-[2-[(1S)-2,6,6-trimethylcyclohexa-2,4-dien-1-yl]ethyl]heptadeca-2,4,6,8,10,12,14,16-octaenal | 21773679 | Click to see | 566.90 | unknown | via CMAUP database |
| (3E,5E,7E,9E,11E,13E,15E,17E)-1-[(1R,4S)-1,4-dihydroxy-2,2-dimethyl-6-methylidenecyclohexyl]-3,7,12,16-tetramethyl-18-[(1S)-2,6,6-trimethylcyclohexa-2,4-dien-1-yl]octadeca-3,5,7,9,11,13,15,17-octaen-2-one | 21773684 | Click to see | 582.90 | unknown | via CMAUP database |
| Anhydromicromonol | 21773680 | Click to see CC1=C(C(CC(C1)O)(C)C)C=CC(=CC=CC(=CC=CC=C(C)C=CC=C(CCC2C(=CC=CC2(C)C)C)CO)C)C | 568.90 | unknown | via CMAUP database |
| Micromonal | 16061301 | Click to see | 584.90 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Prenol lipids / Triterpenoids | |||||
| (+)-Ursolic Acid | 64945 | Click to see | 456.70 | unknown | https://doi.org/10.1021/NP50057A012 |
| (5Z)-5-[(2E,4E,6E,8E,10E,12E)-13-[(1S,4S,6R)-4-hydroxy-2,2,6-trimethyl-7-oxabicyclo[4.1.0]heptan-1-yl]-2,7,11-trimethyltrideca-2,4,6,8,10,12-hexaenylidene]-3-[2-[(1S)-2,6,6-trimethylcyclohexa-2,4-dien-1-yl]ethyl]furan-2-one | 21773681 | Click to see CC1=CC=CC(C1CCC2=CC(=CC(=CC=CC=C(C)C=CC=C(C)C=CC34C(CC(CC3(O4)C)O)(C)C)C)OC2=O)(C)C | 596.80 | unknown | via CMAUP database |
| Alpha-Amyrin | 73170 | Click to see | 426.70 | unknown | https://doi.org/10.1021/NP50057A012 |
| Amyrin palmitate | 13915598 | Click to see | 665.10 | unknown | https://doi.org/10.1016/S0031-9422(00)94818-0 |
| Beta-Amyrin | 73145 | Click to see CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1)C)C)C | 426.70 | unknown | via CMAUP database |
| Beta-Amyrin Palmitate | 13915599 | Click to see | 665.10 | unknown | https://doi.org/10.1016/S0031-9422(00)94818-0 |
| Betulonic acid | 122844 | Click to see CC(=C)C1CCC2(C1C3CCC4C5(CCC(=O)C(C5CCC4(C3(CC2)C)C)(C)C)C)C(=O)O | 454.70 | unknown | via CMAUP database |
| Lupeol | 259846 | Click to see CC(=C)C1CCC2(C1C3CCC4C5(CCC(C(C5CCC4(C3(CC2)C)C)(C)C)O)C)C | 426.70 | unknown | https://doi.org/10.1021/NP50057A012 |
| Lupeol Acetate | 92157 | Click to see | 468.80 | unknown | https://doi.org/10.1021/NP50057A012 |
| Oleanolic Acid | 10494 | Click to see | 456.70 | unknown | via CMAUP database |
| Taraxasterol | 115250 | Click to see | 426.70 | unknown | via CMAUP database |
| Taraxasterol Acetate | 13889352 | Click to see CC1C2C3CCC4C5(CCC(C(C5CCC4(C3(CCC2(CCC1=C)C)C)C)(C)C)OC(=O)C)C | 468.80 | unknown | via CMAUP database |
| > Lipids and lipid-like molecules / Steroids and steroid derivatives / Cycloartanols and derivatives | |||||
| 9,19-Cyclo-9beta-lanost-24-en-3beta-ol | 500213 | Click to see CC(CCC=C(C)C)C1CCC2(C1(CCC34C2CCC5C3(C4)CCC(C5(C)C)O)C)C | 426.70 | unknown | https://doi.org/10.1016/0031-9422(80)83085-8 |
| Cycloartenol | 92110 | Click to see CC(CCC=C(C)C)C1CCC2(C1(CCC34C2CCC5C3(C4)CCC(C5(C)C)O)C)C | 426.70 | unknown | https://doi.org/10.1016/0031-9422(80)83085-8 |
| > Lipids and lipid-like molecules / Steroids and steroid derivatives / Ergostane steroids / Ergosterols and derivatives | |||||
| (24R)-5-Ergosten-3beta-ol | 312822 | Click to see | 400.70 | unknown |
https://doi.org/10.1016/S0031-9422(00)94818-0 https://doi.org/10.1021/NP50078A010 https://doi.org/10.1016/0031-9422(80)83085-8 |
| (3S,8S,9S,14S,17R)-17-[(2R,5R)-5,6-dimethylheptan-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol | 134766514 | Click to see | 400.70 | unknown | https://doi.org/10.1021/NP50078A010 |
| Campesterol | 173183 | Click to see CC(C)C(C)CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C | 400.70 | unknown |
https://doi.org/10.1016/0031-9422(80)83085-8 https://doi.org/10.1016/S0031-9422(00)94818-0 |
| > Lipids and lipid-like molecules / Steroids and steroid derivatives / Steroid esters | |||||
| [17-(5,6-dimethylheptan-2-yl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] hexadecanoate | 13747840 | Click to see | 639.10 | unknown | https://doi.org/10.1016/S0031-9422(00)94818-0 |
| [17-(5,6-dimethylheptan-2-yl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] octadeca-9,12-dienoate | 77610361 | Click to see | 663.10 | unknown | https://doi.org/10.1016/S0031-9422(00)94818-0 |
| 18:2 Campesteryl ester | 69169003 | Click to see CCCCCC=CCC=CCCCCCCCC(=O)OC1CCC2(C3CCC4(C(C3CC=C2C1)CCC4C(C)CCC(C)C(C)C)C)C | 663.10 | unknown | https://doi.org/10.1016/S0031-9422(00)94818-0 |
| Campesteryl palmitate | 13747841 | Click to see | 639.10 | unknown | https://doi.org/10.1016/S0031-9422(00)94818-0 |
| > Lipids and lipid-like molecules / Steroids and steroid derivatives / Steroid lactones / Cardenolides and derivatives / Cardenolide glycosides and derivatives | |||||
| (3S,5S,10S,13R,14S)-5,14-dihydroxy-3-[(2R,4S,5S,6R)-4-hydroxy-6-methyl-5-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-13-methyl-17-(5-oxo-2H-furan-3-yl)-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-10-carbaldehyde | 6325155 | Click to see CC1C(C(CC(O1)OC2CCC3(C4CCC5(C(CCC5(C4CCC3(C2)O)O)C6=CC(=O)OC6)C)C=O)O)OC7C(C(C(CO7)O)O)O | 666.80 | 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 |
| 17-(5-ethyl-6-methylhept-3-en-2-yl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol | 122544 | Click to see | 412.70 | unknown | https://doi.org/10.1016/S0031-9422(00)94818-0 |
| 17-(5-ethyl-6-methylheptan-2-yl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol | 86821 | Click to see CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(C)C | 414.70 | unknown | https://doi.org/10.1021/NP50057A012 |
| 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/10.1021/NP50057A012 |
| 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/10.1021/NP50057A012 |
| Stigmast-5-en-3-ol | 22012 | Click to see | 414.70 | unknown | https://doi.org/10.1021/NP50057A012 |
| Stigmasterol | 5280794 | Click to see | 412.70 | unknown |
https://doi.org/10.1016/S0031-9422(00)94818-0 https://doi.org/10.1021/NP50078A010 |
| > Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Phenylalanine and derivatives | |||||
| Asperglaucide | 10026486 | Click to see CC(=O)OCC(CC1=CC=CC=C1)NC(=O)C(CC2=CC=CC=C2)NC(=O)C3=CC=CC=C3 | 444.50 | unknown | https://doi.org/10.1016/0031-9422(80)83085-8 |
| Npc171139 | 9832120 | Click to see | 444.50 | unknown | https://doi.org/10.1016/0031-9422(80)83085-8 |
| > Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Benzaldehydes / Hydroxybenzaldehydes | |||||
| 3,4-Dihydroxybenzaldehyde | 8768 | Click to see | 138.12 | unknown | via CMAUP database |
| > Organic oxygen compounds / Organooxygen compounds / Ethers / Diarylethers | |||||
| (1R,14S)-6,20,21,25-tetramethoxy-15,30-dimethyl-23-oxa-15,30-diazaheptacyclo[22.6.2.13,7.18,12.114,18.027,31.022,33]pentatriaconta-3(35),4,6,8,10,12(34),18,20,22(33),24,26,31-dodecaen-9-ol | 70692876 | Click to see CN1CCC2=CC(=C3C=C2C1CC4=CC(=C(C=C4)OC)C5=C(C=CC(=C5)CC6C7=C(O3)C(=C(C=C7CCN6C)OC)OC)O)OC | 622.70 | unknown | via CMAUP database |
| 12'-Methoxyantioquine | 102153330 | Click to see CN1CCC2=CC(=C3C=C2C1CC4=CC(=C(C=C4)OC)C5=C(C=CC(=C5)CC6C7=C(O3)C(=C(C=C7CCN6C)OC)O)OC)OC | 622.70 | unknown | via CMAUP database |
| 6,20,25-Trimethoxy-23-oxa-15,30-diazaheptacyclo[22.6.2.13,7.18,12.114,18.027,31.022,33]pentatriaconta-1(30),3(35),4,6,8,10,12(34),14,18,20,22(33),24,26,31-tetradecaene-9,21-diol | 10579074 | Click to see | 576.60 | unknown | via CMAUP database |
| Tiliageine | 76315750 | Click to see | 608.70 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Indoles and derivatives / Indolecarboxylic acids and derivatives | |||||
| Indole-3-carboxylic acid | 69867 | Click to see C1=CC=C2C(=C1)C(=CN2)C(=O)O | 161.16 | unknown | via CMAUP database |
| Methyl indole-3-carboxylate | 589098 | Click to see | 175.18 | unknown | via CMAUP database |
| > Organoheterocyclic compounds / Indoles and derivatives / Indoles / 3-alkylindoles | |||||
| (-)-Conolidine | 51051654 | Click to see | 266.34 | unknown | https://doi.org/10.3987/R-1985-12-2975 |
| (4R,15S,16S,18R)-15-ethyl-4-hydroxy-17-oxa-1,11-diazapentacyclo[13.4.1.04,12.05,10.016,18]icosa-5,7,9,11-tetraen-13-one | 10860385 | Click to see | 326.40 | unknown |
https://doi.org/10.1080/10575639608043239 https://doi.org/10.1002/CHIN.200334196 https://doi.org/10.1039/B301167D |
| (4S,15R,16R,18S)-15-ethyl-17-oxa-1,11-diazapentacyclo[13.4.1.04,12.05,10.016,18]icosa-5,7,9,11-tetraen-4-ol | 162213031 | Click to see | 312.40 | unknown | https://doi.org/10.1055/S-2006-962479 |
| 14-Ethylidene-1,10-diazatetracyclo[11.2.2.03,11.04,9]heptadeca-3(11),4,6,8-tetraen-12-one | 75607525 | Click to see | 266.34 | unknown | https://doi.org/10.3987/R-1985-12-2975 |
| 15-Ethyl-4-hydroxy-17-oxa-1,11-diazapentacyclo[13.4.1.04,12.05,10.016,18]icosa-5,7,9,11-tetraen-13-one | 85292078 | Click to see CCC12CC(=O)C3=NC4=CC=CC=C4C3(CCN(C1)CC5C2O5)O | 326.40 | unknown | https://doi.org/10.1039/B301167D |
| methyl (1S,10R,15S,16R,18S)-16-ethyl-10-hydroxy-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2,4,6,8-tetraene-1-carboxylate | 162865197 | Click to see | 354.40 | unknown | https://doi.org/10.1016/0031-9422(80)83085-8 |
| Methyl 16-ethyl-10-hydroxy-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2,4,6,8-tetraene-1-carboxylate | 162865196 | Click to see | 354.40 | unknown | https://doi.org/10.1016/0031-9422(80)83085-8 |
| > Organoheterocyclic compounds / Indoles and derivatives / Indolyl carboxylic acids and derivatives | |||||
| Tryptophan | 6305 | Click to see C1=CC=C2C(=C1)C(=CN2)CC(C(=O)O)N | 204.22 | unknown | https://doi.org/10.1055/S-2006-957879 |
| > Organoheterocyclic compounds / Indoles and derivatives / Tryptamines and derivatives | |||||
| Tryptamine | 1150 | Click to see C1=CC=C2C(=C1)C(=CN2)CCN | 160.22 | unknown |
https://doi.org/10.1055/S-2006-961445 https://doi.org/10.1055/S-2006-957879 https://doi.org/10.1007/BF00235298 https://doi.org/10.1016/S0031-9422(00)90584-3 |
| > Organoheterocyclic compounds / Lactams / Beta lactams / Carbapenems | |||||
| Carbapenem | 441133 | Click to see | 153.14 | unknown |
https://doi.org/10.1016/0031-9422(95)00266-A https://doi.org/10.1039/B301167D |
| > Organoheterocyclic compounds / Pyrroloazepines | |||||
| (17-Ethyl-9-methoxy-5,14-diazapentacyclo[12.4.1.03,16.04,12.06,11]nonadeca-4(12),6(11),7,9-tetraen-3-yl) acetate | 162952256 | Click to see | 368.50 | unknown | https://doi.org/10.1016/0031-9422(74)80344-4 |
| (1R,15S,16R,18S)-16-ethyl-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4,6,8-tetraene | 163186489 | Click to see CCC1CC2C3CC1CN2CCC4=C3NC5=CC=CC=C45 | 280.40 | unknown | https://doi.org/10.1016/0031-9422(80)83085-8 |
| [(1R,3S,16R,17S)-17-ethyl-9-methoxy-5,14-diazapentacyclo[12.4.1.03,16.04,12.06,11]nonadeca-4(12),6(11),7,9-tetraen-3-yl] acetate | 163195511 | Click to see CCC1CC2CC3(C1CN(C2)CC4=C3NC5=C4C=C(C=C5)OC)OC(=O)C | 368.50 | unknown | https://doi.org/10.1016/0031-9422(74)80344-4 |
| 16-Ethyl-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4,6,8-tetraene | 163068898 | Click to see CCC1CC2C3CC1CN2CCC4=C3NC5=CC=CC=C45 | 280.40 | unknown | https://doi.org/10.1016/0031-9422(80)83085-8 |
| methyl (1S,12R,15S,16R,18S)-16-ethyl-12-hydroxy-11-oxo-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4,6,8-tetraene-1-carboxylate | 163189434 | Click to see CCC1CC2C3(CC1CN2C(C(=O)C4=C3NC5=CC=CC=C54)O)C(=O)OC | 368.40 | unknown | https://doi.org/10.1016/0031-9422(80)83085-8 |
| methyl (1S,15S,16R,18S)-16-[(1S)-1-hydroxyethyl]-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4,6,8-tetraene-1-carboxylate | 163186958 | Click to see | 354.40 | unknown | https://doi.org/10.1016/0031-9422(80)83085-8 |
| methyl (1S,15S,16R,18S)-16-ethyl-11-oxo-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4,6,8-tetraene-1-carboxylate | 163193418 | Click to see | 352.40 | unknown | https://doi.org/10.1016/0031-9422(80)83085-8 |
| methyl (1S,15S,16R,18S)-16-ethyl-12-oxo-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4,6,8-tetraene-1-carboxylate | 163191250 | Click to see | 352.40 | unknown | https://doi.org/10.1016/0031-9422(80)83085-8 |
| Methyl 16-(1-hydroxyethyl)-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4,6,8-tetraene-1-carboxylate | 163092258 | Click to see | 354.40 | unknown | https://doi.org/10.1016/0031-9422(80)83085-8 |
| Methyl 16-ethyl-11-oxo-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4,6,8-tetraene-1-carboxylate | 163034330 | Click to see CCC1CC2C3(CC1CN2CC(=O)C4=C3NC5=CC=CC=C54)C(=O)OC | 352.40 | unknown | https://doi.org/10.1016/0031-9422(80)83085-8 |
| Methyl 16-ethyl-12-hydroxy-11-oxo-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4,6,8-tetraene-1-carboxylate | 162868641 | Click to see | 368.40 | unknown | https://doi.org/10.1016/0031-9422(80)83085-8 |
| Methyl 16-ethyl-12-oxo-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4,6,8-tetraene-1-carboxylate | 162960474 | Click to see | 352.40 | unknown | https://doi.org/10.1016/0031-9422(80)83085-8 |
| > Organoheterocyclic compounds / Quinolines and derivatives / Benzoquinolines / Phenanthridines and derivatives | |||||
| (1S,12R,13Z,18S)-13-ethylidene-9,15-diazapentacyclo[10.5.2.02,11.03,8.015,18]nonadeca-2(11),3,5,7,9-pentaen-1-ol | 101106477 | Click to see | 292.40 | unknown | https://doi.org/10.1002/CHIN.200334196 |
| (1S,12S,13E,18S)-13-ethylidene-9,15-diazapentacyclo[10.5.2.02,11.03,8.015,18]nonadeca-2(11),3,5,7,9-pentaen-1-ol | 21603359 | Click to see | 292.40 | unknown | https://doi.org/10.1039/B301167D |
| 13-Ethylidene-9,15-diazapentacyclo[10.5.2.02,11.03,8.015,18]nonadeca-2(11),3,5,7,9-pentaen-1-ol | 73798925 | Click to see CC=C1CN2CCC3(C2CC1C4=C3C5=CC=CC=C5N=C4)O | 292.40 | unknown | https://doi.org/10.1039/B301167D |
| > Organoheterocyclic compounds / Quinolines and derivatives / Quinolones and derivatives / Hydroquinolones | |||||
| (3S,4S,6R,11R)-3-ethyl-11-hydroxy-5-oxa-8,18-diazapentacyclo[9.7.1.13,8.04,6.012,17]icosa-1(18),12,14,16-tetraen-19-one | 101243263 | Click to see | 326.40 | unknown |
https://doi.org/10.1016/0031-9422(95)00266-A https://doi.org/10.1016/S0040-4039(00)91590-9 https://doi.org/10.1002/CHIN.200334196 https://doi.org/10.1039/B301167D |
| 3-Ethyl-11-hydroxy-5-oxa-8,18-diazapentacyclo[9.7.1.13,8.04,6.012,17]icosa-1(18),12,14,16-tetraen-19-one | 162876595 | Click to see | 326.40 | unknown |
https://doi.org/10.1016/0031-9422(95)00266-A https://doi.org/10.1039/B301167D |
| > Phenylpropanoids and polyketides / 2-arylbenzofuran flavonoids | |||||
| Salvianolic acid C | 13991590 | Click to see | 492.40 | unknown | https://doi.org/10.1016/J.BMCL.2015.07.036 |
| > Phenylpropanoids and polyketides / Cinnamic acids and derivatives / Hydroxycinnamic acids and derivatives / Coumaric acids and derivatives | |||||
| 3,4-Dihydroxycinnamic acid methyl ester | 92202 | Click to see | 194.18 | unknown | via CMAUP database |
| > Phenylpropanoids and polyketides / Flavonoids / Flavones | |||||
| Apigenin | 5280443 | Click to see C1=CC(=CC=C1C2=CC(=O)C3=C(C=C(C=C3O2)O)O)O | 270.24 | unknown | via CMAUP database |
| > Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glycosides / Flavonoid-3-O-glycosides | |||||
| Rutin | 5280805 | Click to see | 610.50 | unknown | via CMAUP database |
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