input word = C00009518

Metabolite InformationStructural formula
Name Scandinone
Nallanin
Formula C26H26O5
Mw 418.17802394
CAS RN 5233-97-6
C_ID C00009518 ,
InChIKey OUZCFMSJGDEXRT-UHFFFAOYSA-N
InChICode InChI=1S/C26H26O5/c1-15(2)6-11-18-23-19(12-13-26(3,4)31-23)25-21(24(18)29-5)22(28)20(14-30-25)16-7-9-17(27)10-8-16/h6-10,12-14,27H,11H2,1-5H3
SMILES c12c(c(c3c(c1C=CC(O2)(C)C)occ(c3=O)c1ccc(cc1)O)OC)CC=C(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeDeguelia hatschbachii Ref.
PlantaeFabaceaeDerris scandens Ref.
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