Indole-3-carboxylate (BioCAD00000012410)

feces plant natural products

Metabolite Card

Formula: C9H7NO2 (161.0477)
SMILES: OC(=O)C1=CNC2=CC=CC=C12

Synonyms [en]

indole-3-carboxylic acid; 1H-Indole-3-carboxylic acid; Indole - 3 Carboxylate; 3-carboxyindole; 3-Indoleformate; Indole - 3 Carboxylic acid

Reviewed

Last reviewed on 2024-06-28.

Cite this Page

Indole-3-carboxylate. 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: BioCAD00000012410). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Note

Indole-3-carboxylic acid, also known as 3-carboxyindole or 3-indolecarboxylate, belongs to the class of organic compounds known as indolecarboxylic acids and derivatives. Indolecarboxylic acids and derivatives are compounds containing a carboxylic acid group (or a derivative thereof) linked to an indole. Naphthylmethylindoles: Any compound containing a 1H-indol-3-yl-(1-naphthyl)methane structure with substitution at the nitrogen atom of the indole ring by an alkyl, haloalkyl, alkenyl, cycloalkylmethyl, cycloalkylethyl, 1-(N-methyl-2-piperidinyl)methyl, or 2-(4-morpholinyl)ethyl group whether or not further substituted in the indole ring to any extent and whether or not substituted in the naphthyl ring to any extent. One example given is JWH-250. Outside of the human body, indole-3-carboxylic acid has been detected, but not quantified in several different foods, such as brassicas, broccoli, pulses, common beets, and barley. This could make indole-3-carboxylic acid a potential biomarker for the consumption of these foods. Notice the pentyl group substituted onto the nitrogen atom of the indole ring. Note that this definition encompasses only those compounds that have OH groups attached to both the phenyl and the cyclohexyl rings, and so does not include compounds such as O-1871 which lacks the cyclohexyl OH group, or compounds such as JWH-337 or JWH-344 which lack the phenolic OH group.

Entity Information

DBLinks

Other DBLinks
  • CAS Registry Number: 771-50-6
  • PubChem: 69867
  • ChEBI: ChEBI:24809
  • HMDB: HMDB0003320
  • KEGG: C19837
  • NCBI MeSH: indole-3-carboxylic acid
  • Wikipedia: Structural scheduling of synthetic cannabinoids
  • RefMet: RM0040827
  • MoNA: EMBL_MCF_2_0_HRMS_Library000065
  • MoNA: EMBL_MCF_2_0_HRMS_Library000310
  • MoNA: FiehnHILIC000439
  • MoNA: FiehnHILIC001262
  • MoNA: FiehnHILIC002011
  • MoNA: FiehnHILIC002764
  • MoNA: HMDB0003320_ms_ms_2242
  • MoNA: HMDB0003320_ms_ms_2243
  • MoNA: HMDB0003320_ms_ms_2244
  • MoNA: MoNA010065
  • MoNA: MoNA010066
  • MoNA: MoNA010067
  • MoNA: MoNA010068
  • MoNA: MoNA010069
  • MoNA: MoNA010070
  • MoNA: MoNA032812
  • MoNA: MoNA032814
  • MoNA: MoNA032815
  • MoNA: MoNA037392
  • MoNA: PB000615
  • MoNA: PB000616
  • MoNA: PB000617
  • MoNA: PB000618
  • MoNA: PB005785
  • MoNA: PB005786
  • MoNA: PB005787
  • MoNA: PR100988
  • MoNA: PR101045
  • MoNA: PS109101
  • MoNA: PS109102
  • MoNA: PS109107
  • MoNA: PS109108
  • MoNA: PS109109
  • MoNA: PT110910
  • MoNA: PT210910
  • Metlin: METLIN_3795
  • Coconut NaturalProduct: CNP0272837.0

Class / Ontology

Metabolic Network
ID EC Number Name
KEGG:R09488 4.1.1.92 indole-3-carboxylate carboxy-lyase
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Organism Source

Taxonomy Source

  1. Abrus precatorius [ncbi taxid: 3816]
  2. Acanthus ilicifolius [ncbi taxid: 328098]
  3. Achillea biebersteinii [ncbi taxid: 282722]
  4. Acrisione denticulata [ncbi taxid: 462376]
  5. Adenocarpus intermedius [ncbi taxid: ]
  6. Albizia Julibrissin [ncbi taxid: 3813]
  7. Alcea rosea [ncbi taxid: 65557]
  8. Alcyonium utinomii [ncbi taxid: ]
  9. Aldisa sanguinea [ncbi taxid: 2049529]
  10. Alisma orienatale [ncbi taxid: ]
  11. Alisma orientalis [ncbi taxid: ]
  12. Alisma plantago-aquatica subsp. orientale [ncbi taxid: 262913]
  13. Aloe ibitiensis [ncbi taxid: 2304358]
  14. Alpinia blepharocalyx [ncbi taxid: 105668]
  15. Anabaena cylindrica [ncbi taxid: 1165]
  16. Anguilla japonica [ncbi taxid: 7937]
  17. Aonidiella aurantii [ncbi taxid: 30082]
  18. Aplysina archeri [ncbi taxid: 289390]
  19. Aquilegia adoxoides [ncbi taxid: ]
  20. Arabidopsis thaliana [ncbi taxid: 3702]
  21. Araiostegiella perdurans [ncbi taxid: ]
  22. Archidendron ellipticum [ncbi taxid: 392766]
  23. Aspergillus carneus [ncbi taxid: 41282]
  24. Aspergillus striatus [ncbi taxid: 469280]
  25. Baccharis dracunculifolia [ncbi taxid: 72900]
  26. Balanops australiana [ncbi taxid: 1118758]
  27. Bauhinia tarapotensis [ncbi taxid: 871993]
  28. Begonia nantoensis [ncbi taxid: 78253]
  29. Berberis orthobotrys [ncbi taxid: 1433323]
  30. Beta vulgaris [ncbi taxid: 161934]
  31. Blumea eriantha [ncbi taxid: ]
  32. Bulbinella floribunda [ncbi taxid: ]
  33. Calocephalus brownii [ncbi taxid: ]
  34. Calycotome villosa [ncbi taxid: ]
  35. Caryocar villosum [ncbi taxid: 507520]
  36. Cephalanceropsis gracilis [ncbi taxid: ]
  37. Ceriops decandra [ncbi taxid: 172013]
  38. Chamaebatia foliolosa [ncbi taxid: 140996]
  39. Chiton tuberculatus [ncbi taxid: 1539881]
  40. Chlorobaculum tepidum [ncbi taxid: 1097]
  41. Cipadessa fruticosa [ncbi taxid: ]
  42. Citrullus lanatus [ncbi taxid: 3654]
  43. Cladonia impexa [ncbi taxid: ]
  44. Cladosporium cucumerinum [ncbi taxid: 166633]
  45. Codium dwarkense [ncbi taxid: 1676211]
  46. Colladonia triquetra [ncbi taxid: ]
  47. Cortinarius odoratus [ncbi taxid: ]
  48. Cucumis melo [ncbi taxid: 3656]
  49. Cucumis sativus [ncbi taxid: 3659]
  50. Cucumis sativus L. [ncbi taxid: ]
  51. Cucurbita moschata [ncbi taxid: 3662]
  52. Cymbastela coralliophila [ncbi taxid: 85786]
  53. Dalbergia ecastaphyllum [ncbi taxid: 450024]
  54. Diplazium esculentum [ncbi taxid: 29615]
  55. Diplodia quercivora [ncbi taxid: 1281306]
  56. Doronicum austriacum [ncbi taxid: 118751]
  57. Dytiscus marginalis [ncbi taxid: 398601]
  58. Eleutherobia albiflora [ncbi taxid: ]
  59. Eucalyptus jenseni [ncbi taxid: ]
  60. Euonymus laxiflorus [ncbi taxid: 1009469]
  61. Euonymus tingens [ncbi taxid: 1089406]
  62. Euphorbia cornigera [ncbi taxid: 2510634]
  63. Euphorbia formosana [ncbi taxid: 458693]
  64. Ganoderma lucidum [ncbi taxid: 5315]
  65. Glochidion philippicum [ncbi taxid: 271531]
  66. Gonyaulax excavata [ncbi taxid: ]
  67. Guatteria dielsiana [ncbi taxid: ]
  68. Gymnopus confluens [ncbi taxid: ]
  69. Haliclona oculata [ncbi taxid: 6058]
  70. Helianthus occidentalis [ncbi taxid: 73303]
  71. Helichrysum retrorsum [ncbi taxid: 3030127]
  72. Himalaiella deltoidea [ncbi taxid: ]
  73. Homo sapiens [ncbi taxid: 9606]
  74. Humulus japonicus [ncbi taxid: 3485]
  75. Hylocomium splendens [ncbi taxid: 53007]
  76. Ilex brevicuspis [ncbi taxid: 53199]
  77. Ipomoea purga [ncbi taxid: 264534]
  78. Ircinia muscarum [ncbi taxid: ]
  79. Isatis tinctoria [ncbi taxid: 161756]
  80. Kokoona reflexa [ncbi taxid: 1504447]
  81. Lactarius sanguifluus [ncbi taxid: 111137]
  82. Lippia americana [ncbi taxid: 1986360]
  83. Littorina littorea [ncbi taxid: 31216]
  84. Lotus corniculatus [ncbi taxid: 47247]
  85. Lupinus andersoni [ncbi taxid: ]
  86. Macrolepiota neomastoidea [ncbi taxid: ]
  87. Maesa ramentacea [ncbi taxid: 1526298]
  88. Melolontha melolontha [ncbi taxid: 7061]
  89. Millettia laurentii [ncbi taxid: 2747815]
  90. Monodora tenuifolia [ncbi taxid: 306973]
  91. Myoporum platycarpum [ncbi taxid: 796003]
  92. Nectandra gardneri [ncbi taxid: ]
  93. Neonectria coccinea [ncbi taxid: 57153]
  94. Nicotiana tabacum [ncbi taxid: 4097]
  95. Nototodarus sloanii [ncbi taxid: 215440]
  96. Ocimum gratissimum [ncbi taxid: 204144]
  97. Ocimum tenuiflorum [ncbi taxid: 204149]
  98. Olea europaea subsp. cuspidata [ncbi taxid: 129566]
  99. Ongokea gore [ncbi taxid: 350425]
  100. Palaquium canaliculatum [ncbi taxid: 3363855]
  101. Paracoccus denitrificans [ncbi taxid: 266]
  102. Peltigera dolichorrhiza [ncbi taxid: 176453]
  103. Penicillium janczewskii [ncbi taxid: 121612]
  104. Persea lingue [ncbi taxid: 128683]
  105. Persicaria tinctoria [ncbi taxid: 96455]
  106. Phlojodicarpus sibiricus [ncbi taxid: 2893997]
  107. Phonus arborescens [ncbi taxid: 121177]
  108. Physalis sordida [ncbi taxid: 304128]
  109. Pieris japonica [ncbi taxid: 317406]
  110. Pinus strobus [ncbi taxid: 3348]
  111. Pinus sylvestris [ncbi taxid: 3349]
  112. Pisum sativum [ncbi taxid: ]
  113. Pithecellobium racemosum [ncbi taxid: ]
  114. Pluchea odorata [ncbi taxid: 1548633]
  115. Portulaca oleracea [ncbi taxid: 46147]
  116. Prunus serrulata var. spontanea [ncbi taxid: ]
  117. Pseudoplexaura flagellosa [ncbi taxid: 287903]
  118. Pycnarrhena ozantha [ncbi taxid: 2812727]
  119. Pyrus malus [ncbi taxid: ]
  120. Radix rehmanniae [ncbi taxid: ]
  121. Rhizoctonia repens [ncbi taxid: ]
  122. Rusavskia elegans [ncbi taxid: 88742]
  123. Salacia lehmbachii [ncbi taxid: 213839]
  124. Salvia hypoleuca [ncbi taxid: 1294397]
  125. Salvia yosgadensis [ncbi taxid: 1933769]
  126. Sanicula epipactis [ncbi taxid: 52473]
  127. Sarcophyton buitendijki [ncbi taxid: 358794]
  128. Scopolia atropoides [ncbi taxid: ]
  129. Senecio heliopsis [ncbi taxid: ]
  130. Sesamum orientale [ncbi taxid: ]
  131. Shorea pinanga [ncbi taxid: ]
  132. Sideritis brevibracteata [ncbi taxid: ]
  133. Sideroxylon cubense [ncbi taxid: 362723]
  134. Solidago petiolaris [ncbi taxid: 72976]
  135. Stachys annua [ncbi taxid: 1391948]
  136. Streptomyces mutabilis sp. MII [ncbi taxid: ]
  137. Streptomyces purpurogeneiscleroticus [ncbi taxid: 68259]
  138. Streptomyces roseoverticillatus [ncbi taxid: 66429]
  139. Streptomyces sp. G278 [ncbi taxid: ]
  140. Streptomyces tendae TK-VL 333 [ncbi taxid: ]
  141. Streptomyces TK-VL_333 [ncbi taxid: ]
  142. Streptomyces YIM 10049 [ncbi taxid: ]
  143. Swartschewskia papyracea [ncbi taxid: 75886]
  144. Tabernaemontana divaricata [ncbi taxid: 52861]
  145. Taiwanofungus camphoratus [ncbi taxid: 2696576]
  146. Taonia australasica [ncbi taxid: ]
  147. Taraxacum formosanum [ncbi taxid: 170733]
  148. Taxus drupacea [ncbi taxid: ]
  149. Undaria pinnatifida [ncbi taxid: 74381]
  150. Verongula rigida [ncbi taxid: ]
  151. Viguiera decurrens [ncbi taxid: 1048926]
  152. Xanthium strumarium [ncbi taxid: 318068]
  153. Zaluzania grayana [ncbi taxid: 191180]
  154. Zanthoxylum acutifolium [ncbi taxid: ]

Pathway Synthetic

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