input word = C00018865

Metabolite InformationStructural formula
Name Lespedezol A6
3,8,9-Trihydroxy-10-(3,7-dimethyl-2,6-octadienyl)coumestan
Formula C25H24O6
Mw 420.1572885
CAS RN 249891-10-9
C_ID C00018865 ,
InChIKey PBLWSVWYIYVLDE-VGOFMYFVSA-N
InChICode InChI=1S/C25H24O6/c1-13(2)5-4-6-14(3)7-9-17-22(28)19(27)12-18-21-24(31-23(17)18)16-10-8-15(26)11-20(16)30-25(21)29/h5,7-8,10-12,26-28H,4,6,9H2,1-3H3/b14-7+
SMILES CC(C)=CCC/C(C)=C/Cc1c(O)c(O)cc2c1oc1c3ccc(O)cc3oc(=O)c21
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeLespedeza homoloba Ref.
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