input word = C00020017

Metabolite InformationStructural formula
Name Pummeloquinone
Formula C22H16O6
Mw 376.09468824
CAS RN 114032-24-5
C_ID C00020017 ,
InChIKey GPGGGLOHXPWGDO-UHFFFAOYSA-N
InChICode InChI=1S/C22H16O6/c1-11-8-13-15(23)10-17(27-3)21(25)19(13)14(9-11)20-16(26-2)6-4-12-5-7-18(24)28-22(12)20/h4-10H,1-3H3
SMILES c1c(=O)oc2c(c1)ccc(c2c1c2c(cc(c1)C)C(=O)C=C(C2=O)OC)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRutaceaeCitrus sp. Ref.
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OrganismCitrus sp.
ReferenceIto,Chem. Pharm. Bull.,41,(1993),205