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Orthosphenia mexicana

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Table of Contents

Details
Description
Synonyms
Common Names
Subtypes (subspecies, varieties, subvarieties, forms)
Germination/Propagation
Distribution
Links to other databases
Genome
Scientific Literature
Phytochemical Profile
Biological Material
Contributors
Collections

Details Top

Internal ID UUID644057a598da0331828533
Scientific name Orthosphenia mexicana
Authority Standl.
First published in Contr. U.S. Natl. Herb. 23: 684 (1923)

Description Top

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Synonyms Top

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Common names Top

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Subspecies (abbr. subsp./ssp.) Top

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Varieties (abbr. var.) Top

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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

Links to other databases Top

Suggest others/fix!
Database ID/link to page
World Flora Online wfo-0001263302
Tropicos 50207540
KEW urn:lsid:ipni.org:names:176876-2
The Plant List tro-50207540
Open Tree Of Life 755524
NCBI Taxonomy 123438
IPNI 176876-2
iNaturalist 284787
GBIF 3793934
CMAUP NPO10247

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.
Title Authors Publication Released IDs
The Therapeutic Potential of Celastrol in Central Nervous System Disorders: Highlights from In Vitro and In Vivo Approaches Schiavone S, Morgese MG, Tucci P, Trabace L Molecules 03-Aug-2021
PMCID:PMC8347599
doi:10.3390/molecules26154700
PMID:34361850
ChemInform Abstract: Triterpenes from Celastraceae. A. G. GONZALEZ, C. M. GONZALEZ, E. A. FERRO, A. G. RAVELO, X. A. DOMINGUEZ Wiley 24-May-2016
doi:10.1002/CHIN.198821298
Minor Constituents from Orthosphenia mexicana Antonio G. González, L. San Andrés, A. G. Ravelo, J. G. Luis, I. A. Jiménez, X. A. Domínguez American Chemical Society (ACS) 17-Mar-2005
doi:10.1021/NP50066A028
3-Oxo-28,29-Dihydroxyolean-12-Ene from Orthosphenia mexicana Antonio G. Gonzalez, Carmen M. Gonzalez, Angel G. Ravelo, Xorge A. Dominguez, Braulio M. Fraga American Chemical Society (ACS) 17-Mar-2005
doi:10.1021/NP50043A021
Crystal structure of orthosphenic acid Antonio Gonzalez, Braulio M. Fraga, Pedro Gonzalez, Carmen M. Gonzalez, Angel G. Ravelo, Esteban Ferro, Xorge A. Dominguez, Martha Martinez, Aurea Perales, Jose Fayos American Chemical Society (ACS) 12-Mar-2005
doi:10.1021/JO00169A030
Sesquiterpenes from Orthosphenia mexicana Antonio G. Gonzalez, Carmen M. Gonza´lez, Angel G. Ravelo, Braulio M. Frag, Xorge A. Dominguez Elsevier BV 25-Jul-2002
doi:10.1016/0031-9422(88)83123-6
X-ray analysis of netzahualcoyone, a triterpene Quinone methide fromorthosphenia mexicana A.G. González, B.M. Fraga, C.M. González, A.G. Ravelo, E. Ferro, X.A. Domínguez, M.A. Martínez, J. Fayos, A. Perales, M.L. Rodríguez Elsevier BV 25-Jul-2002
doi:10.1016/S0040-4039(00)88088-0

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 / Hydroxybenzoic acid derivatives
3,4-Dihydroxybenzoic acid 72 Click to see C1=CC(=C(C=C1C(=O)O)O)O 154.12 unknown via CMAUP database
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Hydroxybenzoic acid derivatives / Gallic acid and derivatives
4,5,6-Trihydroxy-7-methylphthalide 10420195 Click to see CC1=C2C(=C(C(=C1O)O)O)COC2=O 196.16 unknown via CMAUP database
> Benzenoids / Phenols / Benzenetriols and derivatives / Pyrogallols and derivatives
Flavipin 3083587 Click to see CC1=C(C(=C(C(=C1O)O)O)C=O)C=O 196.16 unknown via CMAUP database
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Agarofurans
(7-Acetyloxy-2,12-dihydroxy-2,6,10,10-tetramethyl-11-oxatricyclo[7.2.1.01,6]dodecan-5-yl) benzoate 13995948 Click to see CC(=O)OC1CC2C(C3(C1(C(CCC3(C)O)OC(=O)C4=CC=CC=C4)C)OC2(C)C)O 432.50 unknown https://doi.org/10.1016/0031-9422(88)83123-6
(7,12-Diacetyloxy-2-hydroxy-2,6,10,10-tetramethyl-11-oxatricyclo[7.2.1.01,6]dodecan-5-yl) benzoate 13995950 Click to see CC(=O)OC1CC2C(C3(C1(C(CCC3(C)O)OC(=O)C4=CC=CC=C4)C)OC2(C)C)OC(=O)C 474.50 unknown https://doi.org/10.1016/0031-9422(88)83123-6
(7,12-Diacetyloxy-2,4-dihydroxy-2,6,10,10-tetramethyl-11-oxatricyclo[7.2.1.01,6]dodecan-5-yl) 3-phenylprop-2-enoate 162973141 Click to see CC(=O)OC1CC2C(C3(C1(C(C(CC3(C)O)O)OC(=O)C=CC4=CC=CC=C4)C)OC2(C)C)OC(=O)C 516.60 unknown https://doi.org/10.1016/0031-9422(88)83123-6
(7,12-Diacetyloxy-2,8-dihydroxy-2,6,10,10-tetramethyl-11-oxatricyclo[7.2.1.01,6]dodecan-5-yl) benzoate 13995956 Click to see CC(=O)OC1C2C(C(C3(C1(C(CCC3OC(=O)C4=CC=CC=C4)(C)O)OC2(C)C)C)OC(=O)C)O 490.50 unknown https://doi.org/10.1016/0031-9422(88)83123-6
(7,8,12-Triacetyloxy-2-hydroxy-2,6,10,10-tetramethyl-11-oxatricyclo[7.2.1.01,6]dodecan-5-yl) benzoate 13995954 Click to see CC(=O)OC1C2C(C3(C(CCC(C3(C1OC(=O)C)C)OC(=O)C4=CC=CC=C4)(C)O)OC2(C)C)OC(=O)C 532.60 unknown https://doi.org/10.1016/0031-9422(88)83123-6
[(1R,2R,5R,6R,7R,8R,9S,12R)-7,8,12-triacetyloxy-2-hydroxy-2,6,10,10-tetramethyl-11-oxatricyclo[7.2.1.01,6]dodecan-5-yl] benzoate 163049259 Click to see CC(=O)OC1C2C(C3(C(CCC(C3(C1OC(=O)C)C)OC(=O)C4=CC=CC=C4)(C)O)OC2(C)C)OC(=O)C 532.60 unknown https://doi.org/10.1016/0031-9422(88)83123-6
[(1R,2S,5S,6S,7S,8S,9S,12R)-7,12-diacetyloxy-2,8-dihydroxy-2,6,10,10-tetramethyl-11-oxatricyclo[7.2.1.01,6]dodecan-5-yl] benzoate 163064589 Click to see CC(=O)OC1C2C(C(C3(C1(C(CCC3OC(=O)C4=CC=CC=C4)(C)O)OC2(C)C)C)OC(=O)C)O 490.50 unknown https://doi.org/10.1016/0031-9422(88)83123-6
[(1S,2S,4R,5R,6R,7S,9R,12R)-7,12-diacetyloxy-2,4-dihydroxy-2,6,10,10-tetramethyl-11-oxatricyclo[7.2.1.01,6]dodecan-5-yl] (E)-3-phenylprop-2-enoate 13995959 Click to see CC(=O)OC1CC2C(C3(C1(C(C(CC3(C)O)O)OC(=O)C=CC4=CC=CC=C4)C)OC2(C)C)OC(=O)C 516.60 unknown https://doi.org/10.1016/0031-9422(88)83123-6
[(1S,2S,4R,5R,6R,7S,9R,12S)-7-acetyloxy-2,4-dihydroxy-2,6,10,10-tetramethyl-5-[(E)-3-phenylprop-2-enoyl]oxy-11-oxatricyclo[7.2.1.01,6]dodecan-12-yl] pyridine-3-carboxylate 162856321 Click to see CC(=O)OC1CC2C(C3(C1(C(C(CC3(C)O)O)OC(=O)C=CC4=CC=CC=C4)C)OC2(C)C)OC(=O)C5=CN=CC=C5 579.60 unknown https://doi.org/10.1016/0031-9422(88)83123-6
[(1S,2S,5S,6S,7S,8S,9R,12R)-7-acetyloxy-5-benzoyloxy-2,8-dihydroxy-2,6,10,10-tetramethyl-11-oxatricyclo[7.2.1.01,6]dodecan-12-yl] pyridine-3-carboxylate 76316064 Click to see CC(=O)OC1C(C2C(C3(C1(C(CCC3(C)O)OC(=O)C4=CC=CC=C4)C)OC2(C)C)OC(=O)C5=CN=CC=C5)O 553.60 unknown https://doi.org/10.1016/0031-9422(88)83123-6
[(1S,2S,5S,6S,7S,8S,9R,12R)-7,12-diacetyloxy-2,8-dihydroxy-2,6,10,10-tetramethyl-11-oxatricyclo[7.2.1.01,6]dodecan-5-yl] benzoate 13995957 Click to see CC(=O)OC1C2C(C(C3(C1(C(CCC3OC(=O)C4=CC=CC=C4)(C)O)OC2(C)C)C)OC(=O)C)O 490.50 unknown https://doi.org/10.1016/0031-9422(88)83123-6
[(1S,2S,5S,6S,7S,8S,9R,12R)-7,8,12-triacetyloxy-2-hydroxy-2,6,10,10-tetramethyl-11-oxatricyclo[7.2.1.01,6]dodecan-5-yl] benzoate 13995955 Click to see CC(=O)OC1C2C(C3(C(CCC(C3(C1OC(=O)C)C)OC(=O)C4=CC=CC=C4)(C)O)OC2(C)C)OC(=O)C 532.60 unknown https://doi.org/10.1016/0031-9422(88)83123-6
[(1S,2S,5S,6S,7S,9R,12R)-7-acetyloxy-2,12-dihydroxy-2,6,10,10-tetramethyl-11-oxatricyclo[7.2.1.01,6]dodecan-5-yl] benzoate 13995949 Click to see CC(=O)OC1CC2C(C3(C1(C(CCC3(C)O)OC(=O)C4=CC=CC=C4)C)OC2(C)C)O 432.50 unknown https://doi.org/10.1016/0031-9422(88)83123-6
[(1S,2S,5S,6S,7S,9R,12R)-7,12-diacetyloxy-2-hydroxy-2,6,10,10-tetramethyl-11-oxatricyclo[7.2.1.01,6]dodecan-5-yl] benzoate 13995951 Click to see CC(=O)OC1CC2C(C3(C1(C(CCC3(C)O)OC(=O)C4=CC=CC=C4)C)OC2(C)C)OC(=O)C 474.50 unknown https://doi.org/10.1016/0031-9422(88)83123-6
[(1S,2S,5S,6S,7S,9R,12R)-7,12-diacetyloxy-6-(acetyloxymethyl)-2-hydroxy-2,10,10-trimethyl-11-oxatricyclo[7.2.1.01,6]dodecan-5-yl] benzoate 13995953 Click to see CC(=O)OCC12C(CCC(C13C(C(CC2OC(=O)C)C(O3)(C)C)OC(=O)C)(C)O)OC(=O)C4=CC=CC=C4 532.60 unknown https://doi.org/10.1016/0031-9422(88)83123-6
[7,12-Diacetyloxy-6-(acetyloxymethyl)-2-hydroxy-2,10,10-trimethyl-11-oxatricyclo[7.2.1.01,6]dodecan-5-yl] benzoate 13995952 Click to see CC(=O)OCC12C(CCC(C13C(C(CC2OC(=O)C)C(O3)(C)C)OC(=O)C)(C)O)OC(=O)C4=CC=CC=C4 532.60 unknown https://doi.org/10.1016/0031-9422(88)83123-6
> Lipids and lipid-like molecules / Prenol lipids / Triterpenoids
10-Hydroxy-2,4a,6a,6a,9,14a-hexamethyl-11-oxo-1,3,4,5,6,13,14,14b-octahydropicene-2-carboxylic acid 4274774 Click to see CC1=C(C(=O)C=C2C1=CC=C3C2(CCC4(C3(CCC5(C4CC(CC5)(C)C(=O)O)C)C)C)C)O 450.60 unknown https://doi.org/10.1016/0031-9422(88)83123-6
2,3-Dihydroxy-7b,9a,12,13b,15a,16-hexamethylicosahydro-5H-3,5a-methanochryseno[2,1-c]oxepine-12-carboxylic acid 3086227 Click to see CC1C23CCC4C(C2CC(C1(OC3)O)O)(CCC5(C4(CCC6(C5CC(CC6)(C)C(=O)O)C)C)C)C 488.70 unknown https://doi.org/10.1021/JO00169A030
https://doi.org/10.1021/NP50043A021
Betulin 72326 Click to see CC(=C)C1CCC2(C1C3CCC4C5(CCC(C(C5CCC4(C3(CC2)C)C)(C)C)O)C)CO 442.70 unknown https://doi.org/10.1021/NP50043A021
Celastrol 122724 Click to see CC1=C(C(=O)C=C2C1=CC=C3C2(CCC4(C3(CCC5(C4CC(CC5)(C)C(=O)O)C)C)C)C)O 450.60 unknown https://doi.org/10.1021/JO00169A030
https://doi.org/10.1016/0031-9422(88)83123-6
CID 122852 122852 Click to see CC1C23CCC4C(C2CCC1(OC3)O)(CCC5(C4(CCC6(C5CC(CC6)(C)C(=O)O)C)C)C)C 472.70 unknown https://doi.org/10.1021/NP50043A021
Orthosphenic acid 20056194 Click to see CC1C23CCC4C(C2CC(C1(OC3)O)O)(CCC5(C4(CCC6(C5CC(CC6)(C)C(=O)O)C)C)C)C 488.70 unknown https://doi.org/10.1021/JO00169A030
https://doi.org/10.1021/NP50043A021
Paniculatadiol 101286253 Click to see CC1(C2CCC3(C(C2(CCC1O)C)CC=C4C3(CCC5(C4CC(CC5)(C)CO)C)C)C)C 442.70 unknown https://doi.org/10.1021/NP50043A021
Pristimerin 159516 Click to see CC1=C(C(=O)C=C2C1=CC=C3C2(CCC4(C3(CCC5(C4CC(CC5)(C)C(=O)OC)C)C)C)C)O 464.60 unknown https://doi.org/10.1021/NP50066A028
Salaspermic acid 44593364 Click to see CC1C23CCC4C(C2CCC1(OC3)O)(CCC5(C4(CCC6(C5CC(CC6)(C)C(=O)O)C)C)C)C 472.70 unknown https://doi.org/10.1021/NP50043A021
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Hydroxysteroids / 3-hydroxysteroids
dimethyl (2S,3S,4aR,6aS,14aS,14bS)-3,10-dihydroxy-2,6,6a,9,14a-pentamethyl-11-oxo-3,4,5,13,14,14b-hexahydro-1H-picene-2,4a-dicarboxylate 21636469 Click to see CC1=C2C3=CC=C4C(=C(C(=O)C=C4C3(CCC2(C5CC(C(CC5(C1)C(=O)OC)O)(C)C(=O)OC)C)C)O)C 522.60 unknown https://doi.org/10.1016/0031-9422(88)83123-6
dimethyl 3,10-dihydroxy-2,6,6a,9,14a-pentamethyl-11-oxo-3,4,5,13,14,14b-hexahydro-1H-picene-2,4a-dicarboxylate 73817662 Click to see CC1=C2C3=CC=C4C(=C(C(=O)C=C4C3(CCC2(C5CC(C(CC5(C1)C(=O)OC)O)(C)C(=O)OC)C)C)O)C 522.60 unknown https://doi.org/10.1016/0031-9422(88)83123-6
https://doi.org/10.1002/CHIN.198821298
methyl (2S,3R,4aR,6aS,14aS,14bS)-3,10-dihydroxy-2,4a,6,6a,9,14a-hexamethyl-4,11-dioxo-1,3,5,13,14,14b-hexahydropicene-2-carboxylate 21579199 Click to see CC1=C2C3=CC=C4C(=C(C(=O)C=C4C3(CCC2(C5CC(C(C(=O)C5(C1)C)O)(C)C(=O)OC)C)C)O)C 492.60 unknown https://doi.org/10.1016/0031-9422(88)83123-6
https://doi.org/10.1016/S0040-4039(00)88088-0
https://doi.org/10.1021/NP50066A028
methyl (2S,3S,4aR,6aS,14aS,14bS)-3,10-dihydroxy-2,4a,6,6a,9,14a-hexamethyl-4,11-dioxo-1,3,5,13,14,14b-hexahydropicene-2-carboxylate 163012526 Click to see CC1=C2C3=CC=C4C(=C(C(=O)C=C4C3(CCC2(C5CC(C(C(=O)C5(C1)C)O)(C)C(=O)OC)C)C)O)C 492.60 unknown https://doi.org/10.1016/S0040-4039(00)88088-0
methyl (2S,3S,4aS,6aS,14aS,14bS)-3,10-dihydroxy-2,4a,6,6a,9,14a-hexamethyl-11-oxo-3,4,5,13,14,14b-hexahydro-1H-picene-2-carboxylate 56841079 Click to see CC1=C2C3=CC=C4C(=C(C(=O)C=C4C3(CCC2(C5CC(C(CC5(C1)C)O)(C)C(=O)OC)C)C)O)C 478.60 unknown https://doi.org/10.1002/CHIN.198821298
Methyl 3,10-dihydroxy-2,4a,6,9,12b,14a-hexamethyl-11-oxo-1,2,3,4,4a,5,11,12b,13,14,14a,14b-dodecahydropicene-2-carboxylate 188774 Click to see CC1=C2C3=CC=C4C(=C(C(=O)C=C4C3(CCC2(C5CC(C(CC5(C1)C)O)(C)C(=O)OC)C)C)O)C 478.60 unknown https://doi.org/10.1016/0031-9422(88)83123-6
Methyl 3,4,10-trihydroxy-2,4a,6,9,12b,14a-hexamethyl-11-oxo-1,2,3,4,4a,5,11,12b,13,14,14a,14b-dodecahydropicene-2-carboxylate 188775 Click to see CC1=C2C3=CC=C4C(=C(C(=O)C=C4C3(CCC2(C5CC(C(C(C5(C1)C)O)O)(C)C(=O)OC)C)C)O)C 494.60 unknown https://doi.org/10.1016/0031-9422(88)83123-6
Netzahualcoyondiol 21579198 Click to see CC1=C2C3=CC=C4C(=C(C(=O)C=C4C3(CCC2(C5CC(C(C(C5(C1)C)O)O)(C)C(=O)OC)C)C)O)C 494.60 unknown https://doi.org/10.1021/NP50066A028
https://doi.org/10.1002/CHIN.198821298
https://doi.org/10.1016/0031-9422(88)83123-6
Netzahualcoyone 163547 Click to see CC1=C2C3=CC=C4C(=C(C(=O)C=C4C3(CCC2(C5CC(C(C(=O)C5(C1)C)O)(C)C(=O)OC)C)C)O)C 492.60 unknown https://doi.org/10.1021/NP50066A028
https://doi.org/10.1016/S0040-4039(00)88088-0
https://doi.org/10.1016/0031-9422(88)83123-6
Netzahualcoyonol 21579197 Click to see CC1=C2C3=CC=C4C(=C(C(=O)C=C4C3(CCC2(C5CC(C(CC5(C1)C)O)(C)C(=O)OC)C)C)O)C 478.60 unknown https://doi.org/10.1016/0031-9422(88)83123-6
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Stigmastanes and derivatives
(3S,8S,9S,10R,13R,14S,17R)-17-[(E,2S,5S)-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 12314479 Click to see CCC(C=CC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(C)C 412.70 unknown via CMAUP database
> Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Aspartic acid and derivatives
N-Caffeoyl-L-aspartic acid 23658567 Click to see C1=CC(=C(C=C1C=CC(=O)NC(CC(=O)O)C(=O)O)O)O 295.24 unknown via CMAUP database
N-Coumaroyl-L-aspartic acid 68537088 Click to see C1=CC(=CC=C1C=CC(=O)NC(CC(=O)O)C(=O)O)O 279.24 unknown via CMAUP database
> Organic acids and derivatives / Carboxylic acids and derivatives / Amino acids, peptides, and analogues / Alpha amino acids and derivatives / Tyrosine and derivatives
N-(E)-Caffeoyl-L-tyrosine 10308838 Click to see C1=CC(=CC=C1CC(C(=O)O)NC(=O)C=CC2=CC(=C(C=C2)O)O)O 343.30 unknown via CMAUP database
N-Coumaroyl-3-hydroxytyrosine 68540305 Click to see C1=CC(=CC=C1C=CC(=O)NC(CC2=CC(=C(C=C2)O)O)C(=O)O)O 343.30 unknown via CMAUP database
N-p-Coumaroyltyrosine 15825666 Click to see C1=CC(=CC=C1CC(C(=O)O)NC(=O)C=CC2=CC=C(C=C2)O)O 327.30 unknown via CMAUP database
trans-Clovamide 6506968 Click to see C1=CC(=C(C=C1CC(C(=O)O)NC(=O)C=CC2=CC(=C(C=C2)O)O)O)O 359.30 unknown via CMAUP database
> Organic nitrogen compounds / Organonitrogen compounds / Quaternary ammonium salts / Cholines
Choline 305 Click to see C[N+](C)(C)CCO 104.17 unknown via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Cyclitols and derivatives / Quinic acids and derivatives
Chlorogenic Acid 1794427 Click to see C1C(C(C(CC1(C(=O)O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)O 354.31 unknown via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Oligosaccharides
Verbascose 441434 Click to see C(C1C(C(C(C(O1)OCC2C(C(C(C(O2)OCC3C(C(C(C(O3)OCC4C(C(C(C(O4)OC5(C(C(C(O5)CO)O)O)CO)O)O)O)O)O)O)O)O)O)O)O)O)O 828.70 unknown via CMAUP database
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Sugar acids and derivatives / Glucuronic acid derivatives
(2R,3R,4S,5S,6S)-3,4,5,6-tetrahydroxyoxane-2-carboxylic acid 90062900 Click to see C1(C(C(OC(C1O)O)C(=O)O)O)O 194.14 unknown via CMAUP database
> Organoheterocyclic compounds / Benzopyrans / 2-benzopyrans
Epicoccolide A 71732639 Click to see CC1=C(C2=C(C(=C1O)O)OC3C4=C(C(=C(C(=C4C(=O)C2O3)C)O)O)O)C=O 374.30 unknown via CMAUP database
> Organoheterocyclic compounds / Imidazopyrimidines / Purines and purine derivatives / Xanthines
Caffeine 2519 Click to see CN1C=NC2=C1C(=O)N(C(=O)N2C)C 194.19 unknown via CMAUP database
Theobromine 5429 Click to see CN1C=NC2=C1C(=O)NC(=O)N2C 180.16 unknown via CMAUP database
> Organoheterocyclic compounds / Isocoumarans
4,6-Dihydroxy-5-methoxy-7-methyl-1,3-dihydroisobenzofuran 123784052 Click to see CC1=C2COCC2=C(C(=C1O)OC)O 196.20 unknown via CMAUP database
7-Methyl-1,3-dihydro-2-benzofuran-4,5,6-triol 10845133 Click to see CC1=C2COCC2=C(C(=C1O)O)O 182.17 unknown via CMAUP database
> Organoheterocyclic compounds / Naphthopyrans
Acetosellin 10883740 Click to see CC=CC=CC=CC1=CC(=C2C3=C1C4=C(COC(C4)CO)C(=O)C3(OC2=O)C)O 394.40 unknown via CMAUP database
> Organoheterocyclic compounds / Tetrahydroisoquinolines
Salsolinol 91588 Click to see CC1C2=CC(=C(C=C2CCN1)O)O 179.22 unknown via CMAUP database
> Phenylpropanoids and polyketides / 2-arylbenzofuran flavonoids
Epicoccolide B 11210533 Click to see CC1=C(C2=C(C(=C1O)O)OC(=C2)C3=C(C(=C(C(=C3C=O)O)O)O)C)C=O 358.30 unknown via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / Biflavonoids and polyflavonoids
(1S,5R,6R,13R,21S)-5,13-bis(3,4-dihydroxyphenyl)-21-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,12,14-trioxapentacyclo[11.7.1.02,11.03,8.015,20]henicosa-2(11),3(8),9,15,17,19-hexaene-6,9,17,19-tetrol 118731401 Click to see C1C(C(OC2=C1C(=CC3=C2C4C(C(O3)(OC5=CC(=CC(=C45)O)O)C6=CC(=C(C=C6)O)O)OC7C(C(C(C(O7)CO)O)O)O)O)C8=CC(=C(C=C8)O)O)O 738.60 unknown via CMAUP database
Cinnamtannin A2 16130899 Click to see C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=C3C(=CC(=C4C5C(C(OC6=C(C(=CC(=C56)O)O)C7C(C(OC8=CC(=CC(=C78)O)O)C9=CC(=C(C=C9)O)O)O)C1=CC(=C(C=C1)O)O)O)O)O)C1=CC(=C(C=C1)O)O)O)O)O)C1=CC(=C(C=C1)O)O)O 1155.00 unknown via CMAUP database
Cinnamtannin A3 16129741 Click to see C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=C3C(=CC(=C4C5C(C(OC6=C(C(=CC(=C56)O)O)C7C(C(OC8=C(C(=CC(=C78)O)O)C9C(C(OC1=CC(=CC(=C91)O)O)C1=CC(=C(C=C1)O)O)O)C1=CC(=C(C=C1)O)O)O)C1=CC(=C(C=C1)O)O)O)O)O)C1=CC(=C(C=C1)O)O)O)O)O)C1=CC(=C(C=C1)O)O)O 1443.30 unknown via CMAUP database
Proanthocyanidin A1 9872976 Click to see C1C(C(OC2=C1C(=CC3=C2C4C(C(O3)(OC5=CC(=CC(=C45)O)O)C6=CC(=C(C=C6)O)O)O)O)C7=CC(=C(C=C7)O)O)O 576.50 unknown via CMAUP database
Procyanidin A2 124025 Click to see C1C(C(OC2=C1C(=CC3=C2C4C(C(O3)(OC5=CC(=CC(=C45)O)O)C6=CC(=C(C=C6)O)O)O)O)C7=CC(=C(C=C7)O)O)O 576.50 unknown via CMAUP database
Procyanidin B1 11250133 Click to see C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=CC(=CC(=C34)O)O)C5=CC(=C(C=C5)O)O)O)O)O)C6=CC(=C(C=C6)O)O)O 578.50 unknown via CMAUP database
Procyanidin B2, (+)- 122738 Click to see C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=CC(=CC(=C34)O)O)C5=CC(=C(C=C5)O)O)O)O)O)C6=CC(=C(C=C6)O)O)O 578.50 unknown via CMAUP database
Procyanidin B5 124017 Click to see C1C(C(OC2=C1C(=C(C(=C2)O)C3C(C(OC4=CC(=CC(=C34)O)O)C5=CC(=C(C=C5)O)O)O)O)C6=CC(=C(C=C6)O)O)O 578.50 unknown via CMAUP database
Procyanidin C1 169853 Click to see C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=C(C(=CC(=C34)O)O)C5C(C(OC6=CC(=CC(=C56)O)O)C7=CC(=C(C=C7)O)O)O)C8=CC(=C(C=C8)O)O)O)O)O)C9=CC(=C(C=C9)O)O)O 866.80 unknown via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / Flavans / Catechins
8,8'-Methylenebiscatechin 46182787 Click to see C1C(C(OC2=C1C(=CC(=C2CC3=C(C=C(C4=C3OC(C(C4)O)C5=CC(=C(C=C5)O)O)O)O)O)O)C6=CC(=C(C=C6)O)O)O 592.50 unknown via CMAUP database
Cianidanol 9064 Click to see C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C=C3)O)O)O 290.27 unknown via CMAUP database
Epicatechin 72276 Click to see C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C=C3)O)O)O 290.27 unknown via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Anthocyanins / Anthocyanidin-3-O-glycosides
Cyanidin 3-O-galactoside 441699 Click to see C1=CC(=C(C=C1C2=[O+]C3=CC(=CC(=C3C=C2OC4C(C(C(C(O4)CO)O)O)O)O)O)O)O 449.40 unknown via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid C-glycosides / Flavonoid 8-C-glycosides
Epicatechin 8-C-beta-D-galactopyranoside 5317057 Click to see C1C(C(OC2=C1C(=CC(=C2C3C(C(C(C(O3)CO)O)O)O)O)O)C4=CC(=C(C=C4)O)O)O 452.40 unknown via CMAUP database
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glycosides / Flavonoid-3-O-glycosides
Cyanidin 3-arabinoside cation 12137509 Click to see C1C(C(C(C(O1)OC2=CC3=C(C=C(C=C3[O+]=C2C4=CC(=C(C=C4)O)O)O)O)O)O)O 419.40 unknown via CMAUP database
Guaijaverin 5481224 Click to see C1C(C(C(C(O1)OC2=C(OC3=CC(=CC(=C3C2=O)O)O)C4=CC(=C(C=C4)O)O)O)O)O 434.30 unknown via CMAUP database
> Phenylpropanoids and polyketides / Macrolides and analogues
Orthosphenine 76316479 Click to see CCC1CCC(=O)OC2C(C(C3(C(C(=O)C4C(C3(C2(C)O)OC4(COC(=O)C5=CC=CC=C15)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C 760.70 unknown https://doi.org/10.1021/NP50066A028

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