input word = C00000581

Metabolite InformationStructural formula
Name Bergaptol
5-Hydroxypsoralen
Formula C11H6O4
Mw 202.02660868
CAS RN 486-60-2
C_ID C00000581 ,
InChIKey GIJHDGJRTUSBJR-UHFFFAOYSA-N
InChICode InChI=1S/C11H6O4/c12-10-2-1-6-9(15-10)5-8-7(11(6)13)3-4-14-8/h1-5,13H
SMILES c12c(ccc(=O)o1)c(c1c(c2)occ1)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApiaceaePetroselinum crispum Ref.
PlantaeRutaceaeCitrus bergamia Ref.
PlantaeRutaceaeCitrus limon Ref.
PlantaeRutaceaeCitrus maxima Ref.
PlantaeRutaceaeCitrus paradisi Ref.
PlantaeRutaceaeCitrus spp. Ref.
--citrus spp. Ref.
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