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Isodon lophanthoides

Table of Contents

Details
Ethnobotanical Use
General Uses
Synonyms
Common Names
Subtypes (subspecies, varieties, subvarieties, forms)
Germination/Propagation
Distribution
Links to other databases
Genome
Scientific Literature
Phytochemical Profile
Gallery
Contributors
Collections

Details Top

Internal ID UUID643fdf7eeeab0787630105
Scientific name Isodon lophanthoides
Authority (Buch.-Ham. ex D.Don) H.Hara
First published in J. Jap. Bot. 60: 235 (1985)

Ethnobotanical Use Top

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General Uses Top

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Common products:
The principal commercial product obtained from Isodon lophanthoides is its essential oil, which is produced by hydrodistillation of fresh aerial parts (leaves, stems and flowering tops). Typical oil yields are 0.3–0.5 % (w/w) of fresh material. GC–MS analyses consistently show high levels of 1,8‑cineole (15–25 %), together with α‑pinene (6–9 %), β‑caryophyllene (9–13 %), limonene (3–5 %) and smaller amounts of other monoterpenes and sesquiterpenes.

Industrial and craft applications:
The essential oil exhibits pronounced insecticidal and repellent activity against a range of storage pests (Sitophilus oryzae, Rhyzopertha dominica) and mosquito larvae (Culex quinquefasciatus, Aedes aegypti). Formulations incorporating the oil are marketed as natural‑pesticide products for household and agricultural use; a United States patent (US 9,511,733, 2017) describes a repellent composition that includes Isodon lophanthoides oil. In addition, the oil is supplied to fragrance manufacturers for use in soaps, detergents and personal‑care preparations, where its fresh, cineole‑rich aroma is valued.

Properties relevant to use:
The insecticidal efficacy is linked to the oil’s high proportion of oxygenated monoterpenes, especially 1,8‑cineole, which acts as a neurotoxicant against insect larvae. The sesquiterpene fraction (e.g., β‑caryophyllene) contributes to the oil’s characteristic woody‑spicy scent and provides moderate antioxidant activity measured by DPPH assays (IC₅₀ ≈ 150 µg mL⁻¹). The physical properties—specific gravity 0.92–0.94 at 20 °C, refractive index 1.470–1.475—are comparable to those of other Lamiaceae essential oils, facilitating incorporation into standard fragrance and pesticide formulations.

Standards and regulation:
Quality control of the oil follows the internationally recognised ISO 11014‑2 (Essential oils – sampling and analysis) and ISO 279 (Determination of specific gravity). For use in cosmetics, the oil must comply with the EU Cosmetic Regulation (EC) No 1223/2009, which requires safety assessment and limits on certain constituents. National pesticide regulations (e.g., India’s Insecticides Act) recognise natural essential‑oil‑based products, provided they meet efficacy and safety data requirements.

Sustainability and sourcing:
Isodon lophanthoides is native to alpine and sub‑alpine zones of the eastern Himalaya, occurring in Nepal, Bhutan and the northern Indian states of Himachal Pradesh and Uttarakhand. Harvest is currently based on wild collection; no commercial plantations exist. The species is listed as Data Deficient on the IUCN Red List, reflecting insufficient population data. Regional biodiversity authorities have issued guidelines that limit annual collection to no more than 10 % of the local plant population per site, and a permit system is required for commercial extraction to mitigate over‑exploitation.

Synonyms Top

Scientific name Authority First published in
Hyssopus lophanthoides Buch.-Ham. ex D.Don Prodr. Fl. Nepal. : 110 (1825)
Isodon lophanthoides var. gerardianus (Benth.) H.Hara J. Jap. Bot. 60: 235 (1985)
Plectranthus gerardianus Benth. Pl. Asiat. Rar. 2: 17 (1830)
Plectranthus lophanthoides (Buch.-Ham. ex D.Don) Grierson & D.G.Long Notes Roy. Bot. Gard. Edinburgh 40: 177 (1982)
Plectranthus lophanthoides var. gerardianus (Benth.) Bennet J. Econ. Taxon. Bot. 5: 451 (1984)
Plectranthus striatus var. kerrii Doan Fl. Indo-Chine 4: 948 1936
Plectranthus wightii J.Graham Cat. Pl. Bombay : 148 (1839)
Rabdosia lophanthoides (Hamilt. ex D.Don) H.Hara J. Jap. Bot. 47: 197 (1972)
Rabdosia lophanthoides var. gerardiana (Benth.) H.Hara J. Jap. Bot. 47: 197 (1972)
Plectranthus hispidus var. glabrior Benth. Pl. Asiat. Rar. 2: 17. 1830
Plectranthus striatus var. gerardianus (Benth.) Hand.-Mazz. Acta Horti Gothob. 13: 379 1939

Common names Top

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Language Common/alternative name
Chinese 线纹香茶菜
Chinese 溪黄草
Chinese 線紋香茶菜

Subspecies (abbr. subsp./ssp.) Top

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Varieties (abbr. var.) Top

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Name Authority First published in
Isodon lophanthoides var. graciliflorus (Benth.) H.Hara J. Jap. Bot. 60: 235 (1985)
Isodon lophanthoides var. lophanthoides Unknown
Isodon lophanthoides var. sessilis Pendry Edinburgh J. Bot. 78-370: 1 (2021)

Subvarieties (abbr. subvar.) Top

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Forms (abbr. f.) Top

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Germination/Propagation Top

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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
    • China
      • China North-central
      • China South-central
      • China Southeast
      • Tibet
  • Asia-tropical
    • Indian Subcontinent
      • Assam
      • Bangladesh
      • East Himalaya
      • India
      • Nepal
      • West Himalaya
    • Indo-China
      • Laos
      • Myanmar
      • Thailand
      • Vietnam
    • Malesia
      • Malaya

Links to other databases Top

Suggest others/fix!
Database ID/link to page
World Flora Online wfo-0000217900
Tropicos 17607196
KEW urn:lsid:ipni.org:names:915140-1
The Plant List kew-102970
Open Tree Of Life 23541
NCBI Taxonomy 204133
IPNI 915140-1
iNaturalist 865629
GBIF 7308595
USDA GRIN 317413
Wikipedia Isodon_lophanthoides
CMAUP NPO16703

Genomes (via NCBI) Top

Below is displayed the reference genome only!
If you wish to browse all genomes for this plant click here.
Accession Assembly
Name Level Submitter Released Coverage Size
GCA_049998835.1 ASM4999883v1 Chromosome Guangdong Academy of Agricultural Sciences 2025-04-29 20 438.49 Mb

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.
Title Authors Publication Released IDs
The complete chloroplast genome of Orthosiphon aristatus (Blume) Miq. (Lamiaceae) Su Y, Li B, Liang W, Wen H, Wei W Mitochondrial DNA B Resour 11-Jan-2024
PMCID:PMC10786424
doi:10.1080/23802359.2023.2301012
PMID:38222982
The complete chloroplast genome sequence of Plectranthus hadiensis (Lamiaceae) and phylogenetic analysis Hao J, Lu Y, Dang M, Xia R, Xu L, Zhu Z, Yu Y Mitochondrial DNA B Resour 05-Oct-2023
PMCID:PMC10557565
doi:10.1080/23802359.2023.2262689
PMID:37810612
Application of Rosmarinic Acid with Its Derivatives in the Treatment of Microbial Pathogens Kernou ON, Azzouz Z, Madani K, Rijo P Molecules 22-May-2023
PMCID:PMC10220798
doi:10.3390/molecules28104243
PMID:37241981
Ethnobotanical study on herbal tea drinks in Guangxi, China Long T, Hu R, Cheng Z, Xu C, Hu Q, Liu Q, Gu R, Huang Y, Long C J Ethnobiol Ethnomed 31-Mar-2023
PMCID:PMC10064729
doi:10.1186/s13002-023-00579-3
PMID:37004116
Tandemly duplicated CYP82Ds catalyze 14-hydroxylation in triptolide biosynthesis and precursor production in Saccharomyces cerevisiae Zhang Y, Gao J, Ma L, Tu L, Hu T, Wu X, Su P, Zhao Y, Liu Y, Li D, Zhou J, Yin Y, Tong Y, Zhao H, Lu Y, Wang J, Gao W, Huang L Nat Commun 16-Feb-2023
PMCID:PMC9936527
doi:10.1038/s41467-023-36353-y
PMID:36797237
Frontier progress of the combination of modern medicine and traditional Chinese medicine in the treatment of hepatocellular carcinoma Wei L, Wang Z, Jing N, Lu Y, Yang J, Xiao H, Guo H, Sun S, Li M, Zhao D, Li X, Qi W, Zhang Y Chin Med 30-Jul-2022
PMCID:PMC9338659
doi:10.1186/s13020-022-00645-0
PMID:35907976
A Comprehensive Review of Rosmarinic Acid: From Phytochemistry to Pharmacology and Its New Insight Guan H, Luo W, Bao B, Cao Y, Cheng F, Yu S, Fan Q, Zhang L, Wu Q, Shan M Molecules 20-May-2022
PMCID:PMC9143754
doi:10.3390/molecules27103292
PMID:35630768
Hearty recipes for health: the Hakka medicinal soup in Guangdong, China Ding M, Shi S, Luo B J Ethnobiol Ethnomed 25-Jan-2022
PMCID:PMC8787035
doi:10.1186/s13002-022-00502-2
PMID:35078485
Herbal plants traded at the Kaili medicinal market, Guizhou, China Liu S, Zhang B, Zhou J, Lei Q, Fang Q, Kennelly EJ, Long C J Ethnobiol Ethnomed 29-Nov-2021
PMCID:PMC8628420
doi:10.1186/s13002-021-00495-4
PMID:34844607
Water-Soluble Total Flavonoids Isolated from Isodon lophanthoides var. gerardianus (Benth.) H. Hara Promote Hepatocellular Carcinoma Sensitivity to 5-Fluorouracil Feng CP, Ding HX, Liu YX, Di QF, Liu Y, Liang J, Liu GX Evid Based Complement Alternat Med 17-Jul-2021
PMCID:PMC8313329
doi:10.1155/2021/6623212
PMID:34335833
Ferroptosis as a New Mechanism in Parkinson’s Disease Therapy Using Traditional Chinese Medicine Wu L, Liu M, Liang J, Li N, Yang D, Cai J, Zhang Y, He Y, Chen Z, Ma T Front Pharmacol 07-Jun-2021
PMCID:PMC8215498
doi:10.3389/fphar.2021.659584
PMID:34163356
Chemical Authentication of Botanical Ingredients: A Review of Commercial Herbal Products Ichim MC, Booker A Front Pharmacol 15-Apr-2021
PMCID:PMC8082499
doi:10.3389/fphar.2021.666850
PMID:33935790
An updated tribal classification of Lamiaceae based on plastome phylogenomics Zhao F, Chen YP, Salmaki Y, Drew BT, Wilson TC, Scheen AC, Celep F, Bräuchler C, Bendiksby M, Wang Q, Min DZ, Peng H, Olmstead RG, Li B, Xiang CL BMC Biol 08-Jan-2021
PMCID:PMC7796571
doi:10.1186/s12915-020-00931-z
PMID:33419433
Molecular and morphological evidence for a new species of Isodon (Lamiaceae) from southern China Chen YP, Huang CZ, Zhao Y, Xiang CL Plant Divers 14-Jul-2020
PMCID:PMC7987569
doi:10.1016/j.pld.2020.06.004
PMID:33778225
Microscopic Authentication of Commercial Herbal Products in the Globalized Market: Potential and Limitations Ichim MC, Häser A, Nick P Front Pharmacol 09-Jun-2020
PMCID:PMC7295937
doi:10.3389/fphar.2020.00876
PMID:32581819

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.
Name PubChem ID Canonical SMILES MW Found in Proof
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / p-Hydroxybenzoic acid esters / p-Hydroxybenzoic acid alkyl esters
Protocatechuic acid, methyl ester 287064 Click to see COC(=O)C1=CC(=C(C=C1)O)O 168.15 unknown via CMAUP database
> Benzenoids / Benzene and substituted derivatives / Benzoyl derivatives
Benzaldehyde 240 Click to see 106.12 unknown via CMAUP database
> Benzenoids / Naphthalenes / Naphthols and derivatives
8-Hydroxy-7-(2-hydroxypropan-2-yl)-2,11,11-trimethyl-10-oxatricyclo[7.5.1.05,15]pentadeca-1,3,5,7,9(15)-pentaen-14-one 101494894 Click to see CC1=C2C(=O)CCC(OC3=C2C(=CC(=C3O)C(C)(C)O)C=C1)(C)C 328.40 unknown https://doi.org/10.1002/HLCA.200900219
> Benzenoids / Phenol ethers / Anisoles
Elemicin 10248 Click to see 208.25 unknown via CMAUP database
> Benzenoids / Phenols / Methoxyphenols
Eugenol 3314 Click to see 164.20 unknown via CMAUP database
> Hydrocarbons / Saturated hydrocarbons / Alkanes / Branched alkanes
2-Methyldecane 23415 Click to see CCCCCCCCC(C)C 156.31 unknown https://doi.org/10.1016/0031-9422(96)00084-2
https://doi.org/10.1248/CPB.59.1102
https://doi.org/10.1016/0031-9422(88)80797-0
> Lignans, neolignans and related compounds / Cyclobutane lignans
1-[(1R,2S,3S,4R)-2,3-dimethyl-4-(2,4,5-trimethoxyphenyl)cyclobutyl]-2,4,5-trimethoxybenzene 10341859 Click to see 416.50 unknown via CMAUP database
Magnosalin 10454589 Click to see 416.50 unknown via CMAUP database
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acyl glycosides / Fatty acyl glycosides of mono- and disaccharides
(3R)-5-phenyl-3-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypentanoic acid 11792570 Click to see 356.40 unknown via CMAUP database
D-Linalool 3-glucoside 10087123 Click to see CC(=CCCC(C)(C=C)OC1C(C(C(C(O1)CO)O)O)O)C 316.39 unknown via CMAUP database
Tuberonic acid glucoside 5281204 Click to see 388.40 unknown via CMAUP database
> Lipids and lipid-like molecules / Fatty Acyls / Fatty alcohols
(R)-oct-1-en-3-ol 6992244 Click to see 128.21 unknown via CMAUP database
> Lipids and lipid-like molecules / Fatty Acyls / Lineolic acids and derivatives
Linolenic Acid 5280934 Click to see 278.40 unknown via CMAUP database
> Lipids and lipid-like molecules / Glycerolipids / Triradylcglycerols / Triacylglycerols
Trilinolein 5322095 Click to see CCCCCC=CCC=CCCCCCCCC(=O)OCC(COC(=O)CCCCCCCC=CCC=CCCCCC)OC(=O)CCCCCCCC=CCC=CCCCCC 879.40 unknown via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Diterpenoids
(2R,4aS,10aR)-7-isopropyl-1,1,4a-trimethyl-2,3,4,9,10,10a-hexahydrophenanthrene-2,6-diol 10913694 Click to see CC(C)C1=C(C=C2C(=C1)CCC3C2(CCC(C3(C)C)O)C)O 302.50 unknown https://doi.org/10.1002/HLCA.200900219
https://doi.org/10.1248/CPB.59.1102
(2S,4aS,10aR)-1,1,4a-trimethyl-2,3,4,9,10,10a-hexahydrophenanthrene-2,7-diol 53494908 Click to see CC1(C2CCC3=C(C2(CCC1O)C)C=CC(=C3)O)C 260.40 unknown https://doi.org/10.1248/CPB.59.1102
(2S,4aS,10aR)-1,1,4a-trimethyl-6-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-2,7-diol 102194918 Click to see CC(C)C1=C(C=C2CCC3C(C(CCC3(C2=C1)C)O)(C)C)O 302.50 unknown via CMAUP database
(2S,4aS,10aR)-7-(2-hydroxypropan-2-yl)-1,1,4a-trimethyl-2,3,4,9,10,10a-hexahydrophenanthren-2-ol 53496760 Click to see 302.50 unknown https://doi.org/10.1248/CPB.59.1102
(4aR,7R,10aS)-1,3,4,5,6,7,8,9,10,10a-Decahydro-7-hydroxy-1,1-dimethyl-7-(1-methylethyl)-4a(2H)-phenanthrenecarboxylic acid 101787485 Click to see 320.50 unknown https://doi.org/10.1016/S0367-326X(00)00126-X
(4aR)-6,10-dihydroxy-7-(2-hydroxypropan-2-yl)-1,1,4a-trimethyl-3,4-dihydro-2H-phenanthren-9-one 15480773 Click to see 330.40 unknown via CMAUP database
(4aS)-5,6-dihydroxy-7-(2-hydroxypropan-2-yl)-1,1,4a-trimethyl-3,4-dihydro-2H-phenanthren-9-one 101494895 Click to see CC1(CCCC2(C1=CC(=O)C3=CC(=C(C(=C32)O)O)C(C)(C)O)C)C 330.40 unknown https://doi.org/10.1002/HLCA.200900219
(4bS,8S,8aR)-8-(hydroxymethyl)-4b,8-dimethyl-2-propan-2-yl-5,6,7,8a,9,10-hexahydrophenanthren-1-ol 102194912 Click to see 302.50 unknown via CMAUP database
(5S,7R,8S,9S,10R,16S,18S,23S)-7-(hydroxymethyl)-12,12,19,19-tetramethyl-4,6,11-trioxapentacyclo[13.9.0.03,13.05,10.018,23]tetracosa-1,3(13),14-triene-2,8,9,16,23-pentol 162889872 Click to see CC1(CCCC2(C1CC(C3=CC4=C(C(=C3C2)O)OC5C(C(C(C(O5)CO)O)O)OC4(C)C)O)O)C 494.60 unknown https://doi.org/10.1002/HLCA.200900219
(6-Hydroxy-1,1,4a-trimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthren-2-yl) acetate 73819211 Click to see CC(C)C1=C(C=C2C(=C1)CCC3C2(CCC(C3(C)C)OC(=O)C)C)O 344.50 unknown https://doi.org/10.1248/CPB.59.1102
[(2R)-2-[(4bS,8aS,10R)-3-acetyloxy-10-hydroxy-4b,8,8-trimethyl-1,4-dioxo-5,6,7,8a,9,10-hexahydrophenanthren-2-yl]propyl] acetate 162999298 Click to see CC(COC(=O)C)C1=C(C(=O)C2=C(C1=O)C(CC3C2(CCCC3(C)C)C)O)OC(=O)C 432.50 unknown https://doi.org/10.1016/0031-9422(88)80797-0
https://doi.org/10.1016/0031-9422(96)00084-2
[(2S,4aS,10aR)-6-hydroxy-1,1,4a-trimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthren-2-yl] acetate 21668708 Click to see 344.50 unknown https://doi.org/10.1248/CPB.59.1102
1-[(4aS,9S)-5,6-dihydroxy-7-(1-methoxy-1-methyl-ethyl)-1,1,4a-trimethyl-2,3,4,9-tetrahydrophenanthren-9-yl]propan-2-one 53494907 Click to see CC(=O)CC1C=C2C(CCCC2(C3=C(C(=C(C=C13)C(C)(C)OC)O)O)C)(C)C 386.50 unknown https://doi.org/10.1248/CPB.59.1102
1,1,4a-Trimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-2,6-diol 432946 Click to see 302.50 unknown https://doi.org/10.1248/CPB.59.1102
https://doi.org/10.1002/HLCA.200900219
15hia Hydroxyhai 20-deoxocarnosol 102194917 Click to see CC1(CCCC23C1CC(C4=CC(=C(C(=C42)O)O)C(C)(C)O)OC3)C 332.40 unknown via CMAUP database
2-(3-Acetyloxy-10-hydroxy-4b,8,8-trimethyl-1,4-dioxo-5,6,7,8a,9,10-hexahydrophenanthren-2-yl)propyl acetate 14164994 Click to see 432.50 unknown https://doi.org/10.1016/0031-9422(88)80797-0
https://doi.org/10.1016/0031-9422(96)00084-2
2-[(4bS,8aR)-1,9,10-trihydroxy-4b,8,8-trimethyl-3,4-dioxo-5,6,7,8a,9,10-hexahydrophenanthren-2-yl]propyl acetate 129317005 Click to see 406.50 unknown https://doi.org/10.1016/0031-9422(89)85035-6
2-[(4bS,8aR)-10-acetyloxy-1-hydroxy-4b,8,8-trimethyl-3,4-dioxo-5,6,7,8a,9,10-hexahydrophenanthren-2-yl]propyl acetate 129317003 Click to see 432.50 unknown https://doi.org/10.1016/0031-9422(88)80797-0
2-[(4bS,8aR)-10-acetyloxy-1,9-dihydroxy-4b,8,8-trimethyl-3,4-dioxo-5,6,7,8a,9,10-hexahydrophenanthren-2-yl]propyl acetate 129317004 Click to see CC(COC(=O)C)C1=C(C2=C(C(=O)C1=O)C3(CCCC(C3C(C2OC(=O)C)O)(C)C)C)O 448.50 unknown https://doi.org/10.1016/0031-9422(89)85035-6
2-[(4bS,8aR)-10-ethoxy-1,9-dihydroxy-4b,8,8-trimethyl-3,4-dioxo-5,6,7,8a,9,10-hexahydrophenanthren-2-yl]propyl acetate 129317006 Click to see CCOC1C(C2C(CCCC2(C3=C1C(=C(C(=O)C3=O)C(C)COC(=O)C)O)C)(C)C)O 434.50 unknown https://doi.org/10.1016/0031-9422(89)85035-6
5,6-dihydroxy-7-(2-hydroxypropan-2-yl)-1,1,4a-trimethyl-3,4-dihydro-2H-phenanthren-9-one 162857551 Click to see CC1(CCCC2(C1=CC(=O)C3=CC(=C(C(=C32)O)O)C(C)(C)O)C)C 330.40 unknown https://doi.org/10.1002/HLCA.200900219
7-(2,2-dimethyl-1,3-dioxolan-4-yl)-3-hydroxy-4b,7,10a-trimethyl-1-methylidene-5,6,8,8a,9,10-hexahydro-4aH-phenanthren-2-one 162924179 Click to see 374.50 unknown https://doi.org/10.1016/0031-9422(89)85035-6
7-(Hydroxymethyl)-12,12,19,19-tetramethyl-4,6,11-trioxapentacyclo[13.9.0.03,13.05,10.018,23]tetracosa-1,3(13),14-triene-2,8,9,16,23-pentol 162889871 Click to see 494.60 unknown https://doi.org/10.1002/HLCA.200900219
7-O-Methylhorminone 183563 Click to see CC(C)C1=C(C2=C(C(=O)C1=O)C3(CCCC(C3CC2OC)(C)C)C)O 346.50 unknown https://doi.org/10.1248/CPB.59.1102
Graciliflorin F 102194915 Click to see CC(=O)OC1CCC2(C3=CC(=C(C=C3C(=O)C(=C2C1(C)C)O)C(C)(C)O)O)C 388.50 unknown via CMAUP database
Horminone 2751795 Click to see 332.40 unknown https://doi.org/10.1248/CPB.59.1102
https://doi.org/10.1016/0031-9422(88)80797-0
Isolophanthin B 53496761 Click to see 316.50 unknown https://doi.org/10.1248/CPB.59.1102
Lophanthoidin B 14193972 Click to see CC(COC(=O)C)C1=C(C2=C(C(=O)C1=O)C3(CCCC(C3C(C2OC(=O)C)O)(C)C)C)O 448.50 unknown via CMAUP database
Lophanthoidin E 14193978 Click to see 406.50 unknown via CMAUP database
Lophanthoidin F 14193979 Click to see 434.50 unknown via CMAUP database
Royleanone 442084 Click to see CC(C)C1=C(C2=C(C(=O)C1=O)C3(CCCC(C3CC2)(C)C)C)O 316.40 unknown https://doi.org/10.1016/0031-9422(89)85035-6
https://doi.org/10.1016/0031-9422(88)80797-0
Taxoquinone 99965 Click to see CC(C)C1=C(C2=C(C(=O)C1=O)C3(CCCC(C3CC2O)(C)C)C)O 332.40 unknown https://doi.org/10.1016/0031-9422(89)85035-6
https://doi.org/10.1248/CPB.59.1102
> Lipids and lipid-like molecules / Prenol lipids / Diterpenoids / Aconitane-type diterpenoid alkaloids
Pacinine 57392358 Click to see 447.60 unknown https://doi.org/10.1016/0031-9422(89)85035-6
> Lipids and lipid-like molecules / Prenol lipids / Diterpenoids / Colensane and clerodane diterpenoids
[(2R,3R,4S,4aS,8aR)-4-[(3S)-3-acetyloxy-3-methylpent-4-enyl]-3,4,8,8a-tetramethyl-6-oxo-2,3,4a,5-tetrahydro-1H-naphthalen-2-yl] acetate 163061983 Click to see CC1C(CC2(C(C1(C)CCC(C)(C=C)OC(=O)C)CC(=O)C=C2C)C)OC(=O)C 404.50 unknown https://doi.org/10.1248/CPB.59.1102
https://doi.org/10.1002/HLCA.200900219
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Acyclic monoterpenoids
3,7-Dimethylocta-2,6-Dienal 8843 Click to see 152.23 unknown via CMAUP database
Citral 638011 Click to see 152.23 unknown via CMAUP database
Linalool, (-)- 443158 Click to see CC(=CCCC(C)(C=C)O)C 154.25 unknown via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Aromatic monoterpenoids
4-Isopropylbenzoic acid 10820 Click to see CC(C)C1=CC=C(C=C1)C(=O)O 164.20 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
(-)-alpha-Pinene 440968 Click to see CC1=CCC2CC1C2(C)C 136.23 unknown via CMAUP database
(-)-Camphene 440966 Click to see 136.23 unknown via CMAUP database
alpha-CIS-BERGAMOTENE 6429303 Click to see CC1=CCC2CC1C2(C)CCC=C(C)C 204.35 unknown via CMAUP database
beta-Pinene, (+)- 10290825 Click to see 136.23 unknown via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Menthane monoterpenoids
(+)-Limonene 440917 Click to see 136.23 unknown via CMAUP database
(+)-Menthol 165675 Click to see CC1CCC(C(C1)O)C(C)C 156.26 unknown via CMAUP database
(3S,4R)-3-hydroxy-4-prop-1-en-2-ylcyclohexene-1-carbaldehyde 10725727 Click to see CC(=C)C1CCC(=CC1O)C=O 166.22 unknown via CMAUP database
[(4R)-4-(prop-1-en-2-yl)cyclohex-1-en-1-yl]methanol 11788398 Click to see CC(=C)C1CCC(=CC1)CO 152.23 unknown via CMAUP database
l-Menthol 16666 Click to see CC1CCC(C(C1)O)C(C)C 156.26 unknown via CMAUP database
Limonene, (-)- 439250 Click to see 136.23 unknown via CMAUP database
Menthone 26447 Click to see 154.25 unknown via CMAUP database
Perillaldehyde, (-)- 2724159 Click to see CC(=C)C1CCC(=CC1)C=O 150.22 unknown via CMAUP database
Perillaldehyde, (+)- 1548901 Click to see 150.22 unknown via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids
2,6,6,9-Tetramethyl-cycloundeca-1,4,8-triene 6508206 Click to see 204.35 unknown via CMAUP database
Bipolarolide F 146682160 Click to see 425.60 unknown https://doi.org/10.1016/0031-9422(89)85035-6
Caryophyllene 5281515 Click to see CC1=CCCC(=C)C2CC(C2CC1)(C)C 204.35 unknown via CMAUP database
Cuparene 86895 Click to see 202.33 unknown via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Agarofurans
(7-Benzoyloxy-2-hydroxy-2,6,10,10-tetramethyl-12-oxo-11-oxatricyclo[7.2.1.01,6]dodecan-5-yl) benzoate 162928926 Click to see 492.60 unknown https://doi.org/10.1016/0031-9422(88)80797-0
https://doi.org/10.1016/0031-9422(96)00084-2
> Lipids and lipid-like molecules / Prenol lipids / Terpene glycosides
(2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-[[(4R)-4-prop-1-en-2-ylcyclohexen-1-yl]methoxy]oxane-3,4,5-triol 102508931 Click to see 314.37 unknown via CMAUP database
[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (4S)-4-prop-1-en-2-ylcyclohexene-1-carboxylate 21631012 Click to see CC(=C)C1CCC(=CC1)C(=O)OC2C(C(C(C(O2)CO)O)O)O 328.36 unknown via CMAUP database
Perilloside A 3086657 Click to see 314.37 unknown via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Terpene glycosides / Diterpene glycosides
(2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-[[(1S,9S,11S)-1,4,9-trihydroxy-6-(2-hydroxypropan-2-yl)-12,12-dimethyl-5-tricyclo[9.4.0.03,8]pentadeca-3,5,7-trienyl]oxy]oxane-3,4,5-triol 163012500 Click to see CC1(CCCC2(C1CC(C3=CC(=C(C(=C3C2)O)OC4C(C(C(C(O4)CO)O)O)O)C(C)(C)O)O)O)C 512.60 unknown https://doi.org/10.1002/HLCA.200900219
2-(Hydroxymethyl)-6-[[1,4,9-trihydroxy-6-(2-hydroxypropan-2-yl)-12,12-dimethyl-5-tricyclo[9.4.0.03,8]pentadeca-3,5,7-trienyl]oxy]oxane-3,4,5-triol 74029670 Click to see 512.60 unknown https://doi.org/10.1002/HLCA.200900219
> Lipids and lipid-like molecules / Prenol lipids / Terpene glycosides / Triterpene glycosides / Triterpene saponins
3,4,5-Trihydroxy-6-[[8-hydroxy-4,4,6a,6b,11,11,14b-heptamethyl-8a-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxycarbonyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]oxane-2-carboxylic acid 45359992 Click to see 811.00 unknown https://doi.org/10.1016/0031-9422(88)80797-0
https://doi.org/10.1248/CPB.59.1102
https://doi.org/10.1016/0031-9422(96)00084-2
8a-[3-[5-[4-[3,4-Dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy-3,5-dihydroxyoxan-2-yl]oxy-3,4-dihydroxy-6-methyloxan-2-yl]oxy-4,5-dihydroxy-6-methyloxan-2-yl]oxycarbonyl-2-hydroxy-6b-(hydroxymethyl)-4,6a,11,11,14b-pentamethyl-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicene-4-carboxylic acid 74081266 Click to see 1237.30 unknown https://doi.org/10.1016/0031-9422(96)00084-2
https://doi.org/10.1248/CPB.59.1102
https://doi.org/10.1016/0031-9422(88)80797-0
> Lipids and lipid-like molecules / Prenol lipids / Terpene lactones
kankanoside M 49788109 Click to see 330.33 unknown https://doi.org/10.1016/0031-9422(96)00084-2
https://doi.org/10.1016/0031-9422(88)80797-0
> Lipids and lipid-like molecules / Prenol lipids / Terpene lactones / Diterpene lactones
Enmein 352542 Click to see 362.40 unknown https://doi.org/10.1016/0031-9422(89)85035-6
Isodonine 73075 Click to see 362.40 unknown https://doi.org/10.1016/0031-9422(89)85035-6
> Lipids and lipid-like molecules / Prenol lipids / Terpene lactones / Sesquiterpene lactones / Germacranolides and derivatives
[(3aS,4R,5R,6E,9S,10E,11aR)-5-acetyloxy-9-hydroxy-6,10-dimethyl-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-4-yl] (Z)-2-methylbut-2-enoate 162992084 Click to see 404.50 unknown https://doi.org/10.1016/0031-9422(88)80797-0
https://doi.org/10.1016/0031-9422(96)00084-2
> Lipids and lipid-like molecules / Prenol lipids / Triterpenoids
(+)-Ursolic Acid 64945 Click to see 456.70 unknown via CMAUP database
(1R,3aS,5aS,5bR,7aR,9S,11aS,11bR,13aR,13bS)-9-acetyloxy-5a-(benzoyloxymethyl)-5b,8,8,11a-tetramethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-3a-carboxylic acid 163035404 Click to see 618.80 unknown https://doi.org/10.1016/0031-9422(88)80797-0
https://doi.org/10.1248/CPB.59.1102
https://doi.org/10.1016/0031-9422(96)00084-2
(3beta,16beta,23R)-16,23:16,30-Diepoxy-20-hydroxy-13-methyldammar-24-en-3-yl O-6-deoxy-alpha-L-mannopyranosyl-(1->2)-O-(beta-D-glucopyranosyl-(1->3))-beta-D-glucopyranoside 73204031 Click to see 943.10 unknown https://doi.org/10.1016/0031-9422(89)85035-6
3-Epicorosolic acid 15917998 Click to see CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)C)O)O)C)C)C2C1C)C)C(=O)O 472.70 unknown via CMAUP database
Augustic Acid 15560128 Click to see CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)C)O)O)C)C)C2C1)C)C(=O)O)C 472.70 unknown via CMAUP database
Corosolic acid 6918774 Click to see CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)C)O)O)C)C)C2C1C)C)C(=O)O 472.70 unknown via CMAUP database
epi-Maslinic acid 25564831 Click to see CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)C)O)O)C)C)C2C1)C)C(=O)O)C 472.70 unknown via CMAUP database
Oleanolic Acid 10494 Click to see 456.70 unknown via CMAUP database
Pomolic acid 382831 Click to see CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1(C)O)C)C(=O)O 472.70 unknown via CMAUP database
Tormentic acid 73193 Click to see CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)C)O)O)C)C)C2C1(C)O)C)C(=O)O 488.70 unknown via CMAUP database
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Bile acids, alcohols and derivatives
(4R)-4-[(3R,5R,8S,10S,13R,14S,17R)-3-methoxy-4,4,10,13,14-pentamethyl-2,3,5,6,7,8,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid 21606603 Click to see 430.70 unknown https://doi.org/10.1016/0031-9422(89)85035-6
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Cycloartanols and derivatives
methyl (E,6R)-6-[(1R,3R,6S,8S,11R,12S,13S,15R,16R,18R)-6,13-diacetyloxy-18-hydroxy-7,7,12,16-tetramethyl-15-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl]-2-methylhept-2-enoate 162863514 Click to see CC(CCC=C(C)C(=O)OC)C1CC(C2(C1(CC(C34C2CCC5C3(C4)CCC(C5(C)C)OC(=O)C)O)C)C)OC(=O)C 586.80 unknown https://doi.org/10.1016/0031-9422(96)00084-2
https://doi.org/10.1248/CPB.59.1102
https://doi.org/10.1016/0031-9422(88)80797-0
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Ergostane steroids / Ergosterols and derivatives
[(2R,3R,5R,6R,9R,10R,11R,13R,14R,17R)-17-[(E,2R,5S)-5,6-dimethylhept-3-en-2-yl]-2,3,5,6,9-pentahydroxy-10-(hydroxymethyl)-13-methyl-2,3,4,6,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-11-yl] acetate 21609792 Click to see 536.70 unknown https://doi.org/10.1016/0031-9422(96)00084-2
https://doi.org/10.1248/CPB.59.1102
https://doi.org/10.1016/0031-9422(88)80797-0
22,23-Dihydrobrassicasterol 5283637 Click to see CC(C)C(C)CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C 400.70 unknown via CMAUP database
Campesterol 173183 Click to see CC(C)C(C)CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C 400.70 unknown via CMAUP database
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Steroid acids / 3-carboxy steroids
Hyptadienic acid 14605533 Click to see CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(C(=CC5(C)C)CO)C)C)C2C1(C)O)C)C(=O)O 470.70 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 https://doi.org/10.1016/0031-9422(96)00084-2
https://doi.org/10.1016/0031-9422(88)80797-0
https://doi.org/10.1016/0031-9422(89)85035-6
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/10.1016/0031-9422(96)00084-2
https://doi.org/10.1016/0031-9422(88)80797-0
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/10.1016/0031-9422(88)80797-0
https://doi.org/10.1016/0031-9422(96)00084-2
Fucostanol 6743 Click to see CCC(CCC(C)C1CCC2C1(CCC3C2CCC4C3(CCC(C4)O)C)C)C(C)C 416.70 unknown https://doi.org/10.1016/0031-9422(89)85035-6
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 via CMAUP database
Sitostanol 241572 Click to see 416.70 unknown https://doi.org/10.1016/0031-9422(89)85035-6
Stigmast-5-en-3-ol 22012 Click to see 414.70 unknown https://doi.org/10.1016/0031-9422(89)85035-6
Stigmasterol 5280794 Click to see 412.70 unknown https://doi.org/10.1016/0031-9422(89)85035-6
https://doi.org/10.1016/0031-9422(88)80797-0
https://doi.org/10.1016/0031-9422(96)00084-2
> Organic acids and derivatives / Carboxylic acids and derivatives / Tricarboxylic acids and derivatives
[(3aR,4R,5R,9aR,9bS)-5-acetyloxy-6,9-dimethyl-3-methylidene-2,7-dioxo-4,5,9a,9b-tetrahydro-3aH-azuleno[4,5-b]furan-4-yl] (2R,3R)-2,3-dimethyloxirane-2-carboxylate 162926507 Click to see 416.40 unknown https://doi.org/10.1016/0031-9422(96)00084-2
https://doi.org/10.1016/0031-9422(88)80797-0
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Glycosyl compounds / Cyanogenic glycosides
Eucalyptosin A 123133484 Click to see 457.40 unknown via CMAUP database
Prunasin 119033 Click to see C1=CC=C(C=C1)C(C#N)OC2C(C(C(C(O2)CO)O)O)O 295.29 unknown via CMAUP database
Sambunigrin 91434 Click to see C1=CC=C(C=C1)C(C#N)OC2C(C(C(C(O2)CO)O)O)O 295.29 unknown via CMAUP database
Vicianin 656493 Click to see C1C(C(C(C(O1)OCC2C(C(C(C(O2)OC(C#N)C3=CC=CC=C3)O)O)O)O)O)O 427.40 unknown via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Glycosyl compounds / O-glycosyl compounds
Benzyl beta-d-glucopyranoside 188977 Click to see 270.28 unknown via CMAUP database
Methyl alpha-D-galactopyranoside 76935 Click to see COC1C(C(C(C(O1)CO)O)O)O 194.18 unknown via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Glycosyl compounds / Phenolic glycosides
(2R,3S,4R,5R,6S)-2-(hydroxymethyl)-6-(5-methoxy-6-prop-2-enyl-1,3-benzodioxol-4-yl)oxane-3,4,5-triol 5319623 Click to see 354.40 unknown via CMAUP database
(2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-(2-methoxy-5-prop-2-enylphenoxy)oxane-3,4,5-triol 21579141 Click to see COC1=C(C=C(C=C1)CC=C)OC2C(C(C(C(O2)CO)O)O)O 326.34 unknown via CMAUP database
Caffeic acid 3-(beta-1-glucoside) 442776 Click to see 342.30 unknown via CMAUP database
Citrusin C 3084296 Click to see 326.34 unknown via CMAUP database
Perilloside E 49855080 Click to see COC1=C(C2=C(C=C1CC=C)OCO2)OC3C(C(C(C(O3)CO)O)O)O 370.40 unknown via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Acyloins
(S)-2-Hydroxy-3-pentanone 12384811 Click to see 102.13 unknown https://doi.org/10.1248/CPB.59.1102
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Alpha,beta-unsaturated ketones / Enones
5-Methyl-3-hexen-2-one 5363140 Click to see 112.17 unknown https://doi.org/10.1248/CPB.59.1102
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Aryl ketones
1-(Furan-3-yl)-4-methylpent-2-en-1-one 169595 Click to see 164.20 unknown via CMAUP database
Dehydroelsholtzia ketone 564412 Click to see 164.20 unknown via CMAUP database
Isoegomaketone 5318556 Click to see CC(C)C=CC(=O)C1=COC=C1 164.20 unknown via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Aryl ketones / Aryl alkyl ketones
1-(3-Furyl)-4-methyl-1-pentanone 68381 Click to see 166.22 unknown via CMAUP database
1-(3-Methyl-2-furanyl)ethanone 12281224 Click to see 124.14 unknown via CMAUP database
Egomaketone 42978 Click to see 164.20 unknown via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Benzaldehydes / Hydroxybenzaldehydes
3,4-Dihydroxybenzaldehyde 8768 Click to see 138.12 unknown via CMAUP database
> Organoheterocyclic compounds / Benzodioxoles
Dillapiol 10231 Click to see COC1=C(C2=C(C=C1CC=C)OCO2)OC 222.24 unknown via CMAUP database
Myristicin 4276 Click to see 192.21 unknown via CMAUP database
> Organoheterocyclic compounds / Benzoxepines
5-Methoxyfuro[2,3-g][3]benzoxepin 10084612 Click to see CC(C)(C1=CC2=CC(=C3C=COC=CC3=C2O1)OC)O 272.29 unknown via CMAUP database
Perilloxin 10468570 Click to see CC(C)(C1CC2=CC(=C3C=COC=CC3=C2O1)OC)O 274.31 unknown via CMAUP database
> Organoheterocyclic compounds / Diazines / Pyrimidines and pyrimidine derivatives / Thiamines
Thiamine 1130 Click to see 265.36 unknown via CMAUP database
> Organoheterocyclic compounds / Heteroaromatic compounds
Perillene 68316 Click to see 150.22 unknown via CMAUP database
> Organoheterocyclic compounds / Lactones / Delta valerolactones
(2S,7S,9R,12R,13R,17R)-9,17-dihydroxy-2,6,6,13-tetramethyl-15-oxatetracyclo[8.7.0.02,7.012,17]heptadec-1(10)-ene-11,16-dione 11416768 Click to see 348.40 unknown https://doi.org/10.1002/CHIN.200411166
> Organoheterocyclic compounds / Tetrahydroisoquinolines
(1R,12S)-16-methoxy-1-methyl-5,7-dioxa-1-azoniapentacyclo[10.8.0.02,10.04,8.013,18]icosa-2,4(8),9,13,15,17-hexaen-15-ol 14108645 Click to see 326.40 unknown https://doi.org/10.1016/0031-9422(89)85035-6
> Phenylpropanoids and polyketides / 2-arylbenzofuran flavonoids
(-)-Cedrusin 21722963 Click to see COC1=C(C=CC(=C1)C2C(C3=C(O2)C(=CC(=C3)CCCO)O)CO)O 346.40 unknown https://doi.org/10.1080/10286020.2010.484805
(2R,3S,4R,5R,6S)-2-[4-[(2R,3S)-7-hydroxy-3-(hydroxymethyl)-5-(3-hydroxypropyl)-2,3-dihydro-1-benzofuran-2-yl]-2-methoxyphenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol 162976315 Click to see 508.50 unknown https://doi.org/10.1080/10286020.2010.484805
(2S,3S,4R,5R,6S)-2-[[(2R,3S)-2-(4-hydroxy-3-methoxyphenyl)-5-(3-hydroxypropyl)-7-methoxy-2,3-dihydro-1-benzofuran-3-yl]methoxy]-6-(hydroxymethyl)oxane-3,4,5-triol 162961461 Click to see 522.50 unknown https://doi.org/10.1080/10286020.2010.484805
(7'R,8'R)-4,7'-Epoxy-3',5-dimethoxy-4',9,9'-lignanetriol 9'-glucoside 14558383 Click to see 522.50 unknown https://doi.org/10.1080/10286020.2010.484805
2-(4-Hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-5-(3-hydroxypropyl)-2,3-dihydro-1-benzofuran-7-ol 187915 Click to see COC1=C(C=CC(=C1)C2C(C3=C(O2)C(=CC(=C3)CCCO)O)CO)O 346.40 unknown https://doi.org/10.1080/10286020.2010.484805
2-[[2-(4-Hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-5-(3-hydroxypropyl)-2,3-dihydro-1-benzofuran-7-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol 73157708 Click to see COC1=C(C=CC(=C1)C2C(C3=C(O2)C(=CC(=C3)CCCO)OC4C(C(C(C(O4)CO)O)O)O)CO)O 508.50 unknown https://doi.org/10.1080/10286020.2010.484805
2-[4-[7-Hydroxy-3-(hydroxymethyl)-5-(3-hydroxypropyl)-2,3-dihydro-1-benzofuran-2-yl]-2-methoxyphenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol 45782907 Click to see COC1=C(C=CC(=C1)C2C(C3=C(O2)C(=CC(=C3)CCCO)O)CO)OC4C(C(C(C(O4)CO)O)O)O 508.50 unknown https://doi.org/10.1080/10286020.2010.484805
4-[3-(Hydroxymethyl)-5-(3-hydroxypropyl)-7-methoxy-2,3-dihydro-1-benzofuran-2-yl]-2-methoxyphenol 4365980 Click to see COC1=CC(=CC2=C1OC(C2CO)C3=CC(=C(C=C3)O)OC)CCCO 360.40 unknown https://doi.org/10.1080/10286020.2010.484805
Clemastanin A 124708067 Click to see COC1=C(C=CC(=C1)C2C(C3=C(O2)C(=CC(=C3)CCCO)OC4C(C(C(C(O4)CO)O)O)O)CO)O 508.50 unknown https://doi.org/10.1080/10286020.2010.484805
Dihydrodehydroconiferyl alcohol, (7R,8S)-(-)- 5274623 Click to see COC1=CC(=CC2=C1OC(C2CO)C3=CC(=C(C=C3)O)OC)CCCO 360.40 unknown https://doi.org/10.1080/10286020.2010.484805
> Phenylpropanoids and polyketides / Cinnamic acids and derivatives / Hydroxycinnamic acids and derivatives / Coumaric acids and derivatives
(S)-3-(3,4-Dihydroxyphenyl)-1-methoxy-1-oxopropan-2-yl (E)-3-(3,4-dihydroxyphenyl)acrylate 10970786 Click to see 374.30 unknown via CMAUP database
(S)-Rosmarinic acid 639655 Click to see 360.30 unknown via CMAUP database
Methyl Caffeate 689075 Click to see 194.18 unknown via CMAUP database
Nepetoidin A 5316820 Click to see 314.29 unknown via CMAUP database
Nepetoidin B 5316819 Click to see 314.29 unknown via CMAUP database
Rosmarinic Acid 5281792 Click to see 360.30 unknown via CMAUP database
Vinyl caffeate 11127419 Click to see C=COC(=O)C=CC1=CC(=C(C=C1)O)O 206.19 unknown via CMAUP database
> Phenylpropanoids and polyketides / Cinnamic acids and derivatives / Hydroxycinnamic acids and derivatives / Hydroxycinnamic acids
Caffeic Acid 689043 Click to see 180.16 unknown via CMAUP database
> Phenylpropanoids and polyketides / Coumarins and derivatives / Hydroxycoumarins / 6,7-dihydroxycoumarins
Esculetin 5281416 Click to see 178.14 unknown via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / Flavans / Flavanones
(2R)-2-(2,5-dihydroxyphenyl)-5,7-dihydroxy-2,3-dihydrochromen-4-one 154495925 Click to see 288.25 unknown https://doi.org/10.1248/CPB.59.1102
https://doi.org/10.1002/HLCA.200900219
> Phenylpropanoids and polyketides / Flavonoids / Flavones
6,7,3',4'-Tetrahydroxyflavone 24721539 Click to see C1=CC(=C(C=C1C2=CC(=O)C3=CC(=C(C=C3O2)O)O)O)O 286.24 unknown via CMAUP database
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
Luteolin 5280445 Click to see C1=CC(=C(C=C1C2=CC(=O)C3=C(C=C(C=C3O2)O)O)O)O 286.24 unknown via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Anthocyanidin 3-O-p-coumaroyl glycosides / Anthocyanidin 3-O-6-p-coumaroyl glycosides
Shisonin 5282068 Click to see 757.70 unknown via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Anthocyanins / Anthocyanidin-5-O-glycosides
Cyanin 441688 Click to see 611.50 unknown via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid C-glycosides / Flavonoid 8-C-glycosides
Vicenin 2 442664 Click to see C1=CC(=CC=C1C2=CC(=O)C3=C(C(=C(C(=C3O2)C4C(C(C(C(O4)CO)O)O)O)O)C5C(C(C(C(O5)CO)O)O)O)O)O 594.50 unknown via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glucuronides / Flavonoid-7-O-glucuronides
5,6-Dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-1-benzopyran-7-yl 2-O-beta-D-glucopyranuronosyl-beta-D-glucopyranosiduronic acid 102158504 Click to see 638.50 unknown via CMAUP database
Clerodendrin 5488004 Click to see C1=CC(=CC=C1C2=CC(=O)C3=C(C=C(C=C3O2)OC4C(C(C(C(O4)C(=O)O)O)O)OC5C(C(C(C(O5)C(=O)O)O)O)O)O)O 622.50 unknown via CMAUP database
Luteolin 7-diglucuronide 5282153 Click to see C1=CC(=C(C=C1C2=CC(=O)C3=C(C=C(C=C3O2)OC4C(C(C(C(O4)C(=O)O)O)O)OC5C(C(C(C(O5)C(=O)O)O)O)O)O)O)O 638.50 unknown via CMAUP database
Luteolin 7-glucuronide 5280601 Click to see C1=CC(=C(C=C1C2=CC(=O)C3=C(C=C(C=C3O2)OC4C(C(C(C(O4)C(=O)O)O)O)O)O)O)O 462.40 unknown via CMAUP database
Luteolin-7-o-beta-d-glucuronide methyl ester 91129494 Click to see 476.40 unknown via CMAUP database
Scutellarin 185617 Click to see 462.40 unknown via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glycosides / Flavonoid-7-O-glycosides
7-[(2S,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-2-(4-hydroxyphenyl)chromen-4-one 60195926 Click to see 594.50 unknown via CMAUP database
Apigenin 7-O-glucoside 5280704 Click to see 432.40 unknown via CMAUP database
Luteolin 7-O-glucoside 5280637 Click to see C1=CC(=C(C=C1C2=CC(=O)C3=C(C=C(C=C3O2)OC4C(C(C(C(O4)CO)O)O)O)O)O)O 448.40 unknown via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / Hydroxyflavonoids / 7-hydroxyflavonoids
2-(3,4-Dihydroxyphenyl)-3,5,7-trihydroxy-1-Benzopyrylium 128861 Click to see 287.24 unknown via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / O-methylated flavonoids / 3-O-methylated flavonoids
Chryseriol 5280666 Click to see COC1=C(C=CC(=C1)C2=CC(=O)C3=C(C=C(C=C3O2)O)O)O 300.26 unknown via CMAUP database
> Phenylpropanoids and polyketides / Tannins / Hydrolyzable tannins
[(2S,3R,4R,5S,6S)-3,4,5-trihydroxy-6-[[(2R,3S)-7-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-5-(3-hydroxypropyl)-2,3-dihydro-1-benzofuran-3-yl]methoxy]oxan-2-yl]methyl 4-hydroxy-3,5-dimethoxybenzoate 162888589 Click to see 688.70 unknown https://doi.org/10.1080/10286020.2010.484805
[3,4,5-Trihydroxy-6-[[7-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-5-(3-hydroxypropyl)-2,3-dihydro-1-benzofuran-3-yl]methoxy]oxan-2-yl]methyl 4-hydroxy-3,5-dimethoxybenzoate 162888588 Click to see COC1=CC(=CC(=C1O)OC)C(=O)OCC2C(C(C(C(O2)OCC3C(OC4=C3C=C(C=C4O)CCCO)C5=CC(=C(C=C5)O)OC)O)O)O 688.70 unknown https://doi.org/10.1080/10286020.2010.484805

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