input word = C00036568

Metabolite InformationStructural formula
Name 4beta-Demethylxuulanin-4beta-ethyl ether
Formula C23H26O4
Mw 366.18310932
CAS RN 299411-47-5
C_ID C00036568 ,
InChIKey JUEHBQGSIXIHCE-ZSFWTHPBNA-N
InChICode InChI=1S/C23H26O4/c1-5-25-19-13-17(15-9-7-6-8-10-15)26-20-14-18-16(22(24-4)21(19)20)11-12-23(2,3)27-18/h6-12,14,17,19H,5,13H2,1-4H3/t17-,19+/m0/s1
SMILES c12c(c(c3c(c1)OC(C=C3)(C)C)OC)[C@@H](C[C@H](O2)c1ccccc1)OCC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeLonchocarpus xuul Ref.
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