input word = C00009704

Metabolite InformationStructural formula
Name Neoduleen
Formula C18H10O5
Mw 306.05282343
CAS RN 238-67-5
C_ID C00009704 ,
InChIKey YHDQXDYABIYVHP-UHFFFAOYSA-N
InChICode InChI=1S/C18H10O5/c1-2-19-13-5-14-11(3-9(1)13)18-12(7-20-14)10-4-16-17(22-8-21-16)6-15(10)23-18/h1-6H,7-8H2
SMILES c12c(cc3c(c1)OCc1c3oc3c1cc1c(c3)OCO1)cco2
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeNeorautanenia edulis Ref.
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