input word = C00044058

Metabolite InformationStructural formula
Name 4'-Demethylknipholone
Formula C23H16O8
Mw 420.08451749
CAS RN 213010-24-3
C_ID C00044058 ,
InChIKey ANEQQIJCYHLALG-UHFFFAOYSA-N
InChICode InChI=1S/C23H16O8/c1-8-6-12(26)19-20(21(29)10-4-3-5-11(25)17(10)23(19)31)15(8)18-14(28)7-13(27)16(9(2)24)22(18)30/h3-7,25-28,30H,1-2H3
SMILES c1cc(c2c(c1)C(=O)c1c(C2=O)c(cc(c1c1c(c(c(cc1O)O)C(=O)C)O)C)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsphodelaceaeBulbine capitata Ref.
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