input word = C00011820

Metabolite InformationStructural formula
Name Arbutifolin
Formula C20H28O5
Mw 348.193674
CAS RN 80442-33-7
C_ID C00011820 ,
InChIKey ZEPVGWURVYMKCE-MSWORRGCNA-N
InChICode InChI=1S/C20H28O5/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/h6,10,12,16-17,19,21H,4-5,7-9,11H2,1-3H3/b13-6+,15-10-/t16-,17-,19+/m0/s1
SMILES C\1(=C/CC/C(=C/[C@H]2[C@@H]([C@H](C1)OC(=O)CC(C)C)C(=C)C(=O)O2)/CO)/C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeCentaurea arbutifolia Ref.
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