input word = C00020791

Metabolite InformationStructural formula
Name Petiolaride
Formula C20H26O6
Mw 362.17293856
CAS RN 62748-23-6
C_ID C00020791 ,
InChIKey SEKDDFGHOTZSMG-GUMHGCSNNA-N
InChICode InChI=1S/C20H26O6/c1-10-4-5-14-11(2)8-15(25-20(24)13(9-22)6-7-21)17-12(3)19(23)26-18(17)16(10)14/h4,6,12,15-18,21-22H,5,7-9H2,1-3H3/b13-6-/t12-,15-,16+,17-,18-/m1/s1
SMILES C12=C(C[C@H]([C@@H]3[C@@H]([C@H]1C(=CC2)C)OC(=O)[C@@H]3C)OC(=O)/C(=C\CO)/CO)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeAgeratina petiolare Ref.
PlantaeAsteraceaeAgeratina petiolaris Ref.
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