input word = C00011871

Metabolite InformationStructural formula
Name Cordifolia 54
Formula C20H26O6
Mw 362.17293856
CAS RN 91161-82-9
C_ID C00011871 ,
InChIKey HYTGQNKYAUKSKO-KZQBTZAANA-N
InChICode InChI=1S/C20H26O6/c1-6-10(2)18(22)24-13-9-20(5)14(26-20)8-7-11(3)16(21)17-15(13)12(4)19(23)25-17/h6,13-17,21H,3-4,7-9H2,1-2,5H3/b10-6-/t13-,14+,15+,16-,17-,20-/m0/s1
SMILES C1CC(=C)[C@@H]([C@@H]2[C@@H]([C@H](C[C@]3([C@@H]1O3)C)OC(=O)/C(=C\C)/C)C(=C)C(=O)O2)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeErlangea cordifolia Ref.
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