input word = C00050725

Metabolite InformationStructural formula
Name 4-O-Methyl episappanol
Formula C17H18O6
Mw 318.11033831
CAS RN 112529-37-0
C_ID C00050725
InChIKey HHDPKXQKOWHDNA-RXQGYGPJNA-N
InChICode InChI=1S/C17H18O6/c1-22-16-12-4-3-11(18)7-15(12)23-9-17(16,21)8-10-2-5-13(19)14(20)6-10/h2-7,16,18-21H,8-9H2,1H3/t16-,17-/m1/s1
SMILES CO[C@@H]1c2ccc(O)cc2OC[C@]1(O)Cc1ccc(O)c(O)c1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeCaesalpinia sappan Ref.
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