input word = C00012152

Metabolite InformationStructural formula
Name Argophyllin B
Formula C20H28O7
Mw 380.18350325
CAS RN 81686-18-2
C_ID C00012152 ,
InChIKey FWOAAAUYUVVHOD-MAGDMBETNA-N
InChICode InChI=1S/C20H28O7/c1-5-10(2)18(23)26-15-8-20(4)16(27-20)7-13(22)12(9-21)6-14-17(15)11(3)19(24)25-14/h5,12-17,21-22H,3,6-9H2,1-2,4H3/b10-5-/t12-,13+,14-,15-,16-,17+,20+/m1/s1
SMILES C=C1C(=O)O[C@@H]2CC(CO)[C@@H](O)C[C@H]3O[C@@]3(C)C[C@@H](OC(=O)/C(C)=CC)[C@@H]12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeHelianthus annuus Ref.
PlantaeAsteraceaeHelianthus argophyllus Ref.
--Hilianthus annuus Ref.
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