methyl 3,5-di-O-caffeoyl quinate (BioCAD00000537339)

plant natural products microbial natural products

Metabolite Card

Formula: C26H26O12 (530.1424)
SMILES: COC(=O)[C@@]1(O)C[C@@H](OC(=O)\\C=C\\c2ccc(O)c(O)c2)[C@H](O)[C@@H](C1)OC(=O)\\C=C\\c1ccc(O)c(O)c1

Synonyms [en]

methyl 3,5-di-O-caffeoyl quinate; methyl (3R,5R)-3,5-bis{[(2E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy}-1,4-dihydroxycyclohexanecarboxylate; 1ST168460; Macranthoin G; CS-0144262; methyl (1~{S},3~{R},4~{R},5~{R})-3,4-bis[[(~{E})-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy]-1,5-dihydroxy-cyclohexanecarboxylate

Reviewed

Last reviewed on 2024-06-28.

Cite this Page

methyl 3,5-di-O-caffeoyl quinate. 数据之源，洞见之始. SMRUCC genomics institute, a synthetic life researcher from China. https://biocad_registry.innovation.ac.cn/s/(-)-arctiin (retrieved 2026-01-03) (CAD Registry RN: BioCAD00000537339). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Note

A methyl ester resulting from the formal condensation of the carboxy group of 3,5-di-O-caffeoyl quinic acid with methanol. Isolated from Suaeda glauca and Dichrocephala bicolor, it exhibits hepatoprotective activity." []

Entity Information

DBLinks

Other DBLinks
  • CAS Registry Number: 159934-13-1
  • PubChem: 10075681
  • ChEBI: ChEBI:66708
  • NCBI MeSH: 3,4-di-O-caffeoylquinic acid
  • Coconut NaturalProduct: CNP0155732.1
  • Coconut NaturalProduct: CNP0155732.3
  • Coconut NaturalProduct: CNP0155732.6
  • Coconut NaturalProduct: CNP0195423.1
  • Coconut NaturalProduct: CNP0195423.4
  • Coconut NaturalProduct: CNP0195423.6
  • Coconut NaturalProduct: CNP0496615.1
  • Coconut NaturalProduct: CNP0510983.1

Class / Ontology

Metabolic Network
ID EC Number Name
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Organism Source

Taxonomy Source

  1. Acacia armata [ncbi taxid: ]
  2. Adenia globosa [ncbi taxid: 387507]
  3. Adonis sutchuenensis [ncbi taxid: 1882389]
  4. Ageratina adenophora [ncbi taxid: 176616]
  5. Aglaia grandis [ncbi taxid: 306506]
  6. Anaphalis araneosa [ncbi taxid: ]
  7. Artemisia kurramensis [ncbi taxid: 1177124]
  8. Astragalus ernestii [ncbi taxid: 1108645]
  9. Berneuxia thibetica [ncbi taxid: 171445]
  10. Bhesa nitidissima [ncbi taxid: ]
  11. Bongardia chrysogonum [ncbi taxid: 39279]
  12. Briareum asbestinum [ncbi taxid: 86543]
  13. Bunodosoma caissarum [ncbi taxid: 31165]
  14. Calycanthus floridus [ncbi taxid: 3429]
  15. Catunaregam tomentosa [ncbi taxid: 907773]
  16. Chrysanthemum sinense [ncbi taxid: ]
  17. Cis punctifer [ncbi taxid: ]
  18. Cladogynos orientalis [ncbi taxid: 2068634]
  19. Clusia ellipticifolia [ncbi taxid: ]
  20. Colletotrichum gloeosporioides [ncbi taxid: 474922]
  21. Coprinopsis atramentaria [ncbi taxid: 71694]
  22. Dichrocephala bicolor [ncbi taxid: ]
  23. Dumoria heckeli [ncbi taxid: ]
  24. Elizabethkingia meningoseptica [ncbi taxid: 238]
  25. Episcia cupreata [ncbi taxid: 168484]
  26. Eragrostis curvula [ncbi taxid: 38414]
  27. Fritillaria meleagris [ncbi taxid: 134857]
  28. Impatiens edgeworthii [ncbi taxid: 342012]
  29. Ipomoea pes-caprae [ncbi taxid: 89656]
  30. Isophysis tasmanica [ncbi taxid: 49752]
  31. Jasonia candicans [ncbi taxid: ]
  32. Liriodendron tulipifera [ncbi taxid: 3415]
  33. Lonchocarpus laxiflorus [ncbi taxid: ]
  34. Mantella aurantiaca [ncbi taxid: 43514]
  35. Matricaria matricarioides [ncbi taxid: 56017]
  36. Metasequoia glyptostroboides [ncbi taxid: 3371]
  37. Othonna sedifolia [ncbi taxid: 405100]
  38. Petasites japonicus [ncbi taxid: 186965]
  39. pimpinella brachycarpa [ncbi taxid: ]
  40. Plantago lundborgii [ncbi taxid: 197807]
  41. Pterocarpus officinalis [ncbi taxid: 330896]
  42. Ranzania japonica [ncbi taxid: 63353]
  43. Rhabdonia verticillata [ncbi taxid: 257557]
  44. Rothmannia wittii [ncbi taxid: ]
  45. Sapium sebiferum [ncbi taxid: ]
  46. Sideritis arborescens [ncbi taxid: 3475002]
  47. Solanum pseudoquina [ncbi taxid: 2072294]
  48. Stilpnopappus pickelii [ncbi taxid: ]
  49. Streptomyces ehimensis [ncbi taxid: 68195]
  50. Tethya amamensis [ncbi taxid: ]
  51. Tetrapanax papyrifer [ncbi taxid: 46417]
  52. Tolypothrix tenuis [ncbi taxid: 457083]
  53. Vernonia lanuginosa [ncbi taxid: ]
  54. Zanthoxylum myriacanthum [ncbi taxid: 1009510]
  55. Ilex pubescens [ncbi taxid: 185543]
  56. Ipomoea pes-caprae [ncbi taxid: 89656]
  57. pimpinella brachycarpa [ncbi taxid: ]
  58. Perralderia coronopifolia [ncbi taxid: 119184]
  59. Ageratina adenophora [ncbi taxid: 176616]
  60. Akebia quinata [ncbi taxid: 13331]
  61. Akebia trifoliata [ncbi taxid: 155132]
  62. Artemisia ludoviciana [ncbi taxid: 86312]
  63. Lonicera confusa [ncbi taxid: 370638]
  64. Lonicera fulvotomentosa [ncbi taxid: 643838]
  65. Lonicera hypoglauca [ncbi taxid: 638626]
  66. Lonicera japonica [ncbi taxid: 105884]
  67. Lonicera macranthoides [ncbi taxid: 638627]
  68. Aplysia dactylomela [ncbi taxid: 144766]
  69. Ceratozamia kuesteriana [ncbi taxid: 179072]
  70. Conus tessulatus [ncbi taxid: 101317]
  71. Dichrocephala bicolor [ncbi taxid: ]
  72. Echinaster echinophorus [ncbi taxid: 559820]
  73. Ipomoea pes-caprae [ncbi taxid: 89656]
  74. Millettia ichthyochtona [ncbi taxid: 185968]
  75. Neopetrosia exigua [ncbi taxid: 595373]
  76. Parmelia caraccensis [ncbi taxid: ]
  77. Perralderia coronopifolia [ncbi taxid: 119184]
  78. Phagnalon rupestre [ncbi taxid: 943712]
  79. pimpinella brachycarpa [ncbi taxid: ]
  80. Pteris altissima [ncbi taxid: 1481357]
  81. Solidago virgaaurea var. gigantea [ncbi taxid: ]
  82. Suaeda glauca [ncbi taxid: 397272]
  83. Chaerophyllum hirsutum [ncbi taxid: 109101]

Pathway Synthetic

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