input word = C00002857

Metabolite InformationStructural formula
Name Purpurin
Formula C14H8O5
Mw 256.03717337
CAS RN 81-54-9
C_ID C00002857 ,
InChIKey BBNQQADTFFCFGB-UHFFFAOYSA-N
InChICode InChI=1S/C14H8O5/c15-8-5-9(16)14(19)11-10(8)12(17)6-3-1-2-4-7(6)13(11)18/h1-5,15-16,19H
SMILES c1ccc2c(c1)C(=O)c1c(C2=O)c(cc(c1O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRubiaceaeAsperula odorata Ref.
PlantaeRubiaceaeGalium spp. Ref.
PlantaeRubiaceaeRelbunium hypocarpium Ref.
PlantaeRubiaceaeRubia cordifolia Ref.
PlantaeRubiaceaeRubia tinctorum Ref.
PlantaeRubiaceaeRubia wallichiana DECNE Ref.
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