input word = C00012201

Metabolite InformationStructural formula
Name Plucheoside A
Formula C21H32O8
Mw 412.209718
CAS RN 126005-75-2
C_ID C00012201 ,
InChIKey RABRMIJDHUKSES-VYQMIEQUNA-N
InChICode InChI=1S/C21H32O8/c1-10-5-4-6-11(2)14(8-13-12(3)20(26)27-15(13)7-10)28-21-19(25)18(24)17(23)16(9-22)29-21/h6-7,12-19,21-25H,4-5,8-9H2,1-3H3/b10-7+,11-6-/t12-,13+,14+,15+,16-,17-,18+,19+,21-/m1/s1
SMILES C/C1=C/CC/C(C)=C/C2OC(=O)C(C)C2CC1O[C@@H]1OC(CO)[C@@H](O)[C@H](O)C1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaePluchea indica Ref.
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