input word = C00009437

Metabolite InformationStructural formula
Name Psoralenol
Formula C20H18O5
Mw 338.11542369
CAS RN 70522-30-4
C_ID C00009437 ,
InChIKey IPXXMSXJVCGTCG-UHFFFAOYNA-N
InChICode InChI=1S/C20H18O5/c1-20(2)18(22)8-12-7-11(3-6-16(12)25-20)15-10-24-17-9-13(21)4-5-14(17)19(15)23/h3-7,9-10,18,21-22H,8H2,1-2H3/t18-/m1/s1
SMILES CC1(C)Oc2ccc(-c3coc4cc(O)ccc4c3=O)cc2CC1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaePsoralea coryfolia Ref.
PlantaeFabaceaePsoralea corylifolia Ref.
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