input word = C00009561

Metabolite InformationStructural formula
Name Lespedeol B
Formula C25H26O6
Mw 422.17293856
CAS RN 51581-04-5
C_ID C00009561 ,
InChIKey CSZKAJDXUNNJKV-UHFFFAOYNA-N
InChICode InChI=1S/C25H26O6/c1-14(2)5-4-9-25(3)10-8-17-20(31-25)12-21-22(23(17)28)24(29)18(13-30-21)16-7-6-15(26)11-19(16)27/h5-8,10-12,18,26-28H,4,9,13H2,1-3H3/t18-,25-/m1/s1
SMILES c12c(c(c3c(c1)OC[C@@H](C3=O)c1c(cc(cc1)O)O)O)C=C[C@@](O2)(C)CCC=C(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeLespedeza homoloba Ref.
PlantaeFabaceaeSophora tetraptera Ref.
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