input word = C00022606

Metabolite InformationStructural formula
Name 11beta,13-Dihydroarbutifolin
Formula C20H30O5
Mw 350.20932407
CAS RN 80442-56-4
C_ID C00022606 ,
InChIKey CORPOBIVEWKOMG-ACDSCSBHNA-N
InChICode InChI=1S/C20H30O5/c1-12(2)8-18(22)24-16-9-13(3)6-5-7-15(11-21)10-17-19(16)14(4)20(23)25-17/h6,10,12,14,16-17,19,21H,5,7-9,11H2,1-4H3/b13-6+,15-10-/t14-,16-,17+,19+/m0/s1
SMILES C/C1=CCC/C(CO)=C/[C@H]2OC(=O)[C@@H](C)[C@@H]2[C@@H](OC(=O)CC(C)C)C1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeCentaurea arbutifolia Ref.
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