input word = C00018940

Metabolite InformationStructural formula
Name Lespedezol A3
3,8-Dihydroxy-6'-methyl-6'-(4-methyl-3-pentenyl)pyrano[2',3':9,10]pterocarpene
Formula C25H24O5
Mw 404.16237388
CAS RN 221231-76-1
C_ID C00018940 ,
InChIKey DOJCHDKOHMTKAQ-UHFFFAOYNA-N
InChICode InChI=1S/C25H24O5/c1-14(2)5-4-9-25(3)10-8-17-23-18(12-20(27)24(17)30-25)19-13-28-21-11-15(26)6-7-16(21)22(19)29-23/h5-8,10-12,26-27H,4,9,13H2,1-3H3/t25-/m1/s1
SMILES c1(ccc2c(c1)OCc1c2oc2c1cc(c1c2C=C[C@](O1)(CCC=C(C)C)C)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeLespedeza homoloba Ref.
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