input word = C00020846

Metabolite InformationStructural formula
Name Skutchiolide A
Formula C22H26O8
Mw 418.16276781
CAS RN 115547-13-2
C_ID C00020846 ,
InChIKey XDWMWDMIPCSQNB-DPROTXMSNA-N
InChICode InChI=1S/C22H26O8/c1-9-7-8-22(26)11(3)16(27-13(5)23)18(29-20(25)21(6)12(4)30-21)14-10(2)19(24)28-17(14)15(9)22/h7,12,14-18,26H,2-3,8H2,1,4-6H3/t12-,14+,15-,16-,17+,18+,21-,22-/m1/s1
SMILES [C@]12([C@@H]([C@@H]3[C@@H]([C@@H]([C@@H](C1=C)OC(=O)C)OC(=O)[C@@]1(O[C@@H]1C)C)C(=C)C(=O)O3)C(=CC2)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeSquamopappus skutchii Ref.
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