input word = C00000113

Metabolite InformationStructural formula
Name Indole-3-carboxylic acid
Formula C9H7NO2
Mw 161.04767848
CAS RN 771-50-6
C_ID C00000113 ,
InChIKey KMAKOBLIOCQGJP-UHFFFAOYSA-N
InChICode InChI=1S/C9H7NO2/c11-9(12)7-5-10-8-4-2-1-3-6(7)8/h1-5,10H,(H,11,12)
SMILES c1ccc2c(c1)c(c[nH]2)C(=O)O
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Anthranilate
Organism
Kingdom Family Species Reference
AnimaliaChalinidaeHaliclona oculata Ref.
ChromalveolataAlariaceaeUndaria pinnatifida Ref.
PlantaeAsteraceaeTaraxacum formosanum Ref.
PlantaeBegoniaceaeBegonia nantoensis Ref.
PlantaeChenopodiaceaeBeta vulgaris Ref.
PlantaeCruciferaeArabidopsis thaliana Ref.
PlantaeCucurbitaceaeCucumis sativus L. Ref.
PlantaeFabaceaePisum sativum Ref.
PlantaePinaceaePinus sylvestris Ref.
PlantaeRosaceaePyrus malus Ref.
PlantaeSaururaceaeHouttuynia cordata Ref.
PlantaeSolanaceaeNicotiana tabacum Ref.
--Cephalanceropsis gracilis Ref.
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OrganismHouttuynia cordata
ReferenceAhn, J. et al., Bioorg. Med. Chem. Lett., 27, (2017), 2807-2811.