input word = C00009532

Metabolite InformationStructural formula
Name Millettin
Formula C25H22O6
Mw 418.14163844
CAS RN 78338-36-0
C_ID C00009532 ,
InChIKey ZRHZEZGNBCGSBJ-UHFFFAOYSA-N
InChICode InChI=1S/C25H22O6/c1-12(2)5-7-16-22-15(9-10-25(3,4)31-22)20(27)19-21(28)18-14-8-6-13(26)11-17(14)29-24(18)30-23(16)19/h5-6,8-11,26-27H,7H2,1-4H3
SMILES c12c(c(c3c(c1CC=C(C)C)oc1c(c3=O)c3ccc(cc3o1)O)O)C=CC(O2)(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeMillettia auriculata Ref.
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