input word = C00041689

Metabolite InformationStructural formula
Name Neobritannilactone B
Formula C15H20O3
Mw 248.1412445
CAS RN 886990-00-7
C_ID C00041689 ,
InChIKey PDEJECFRCJOMEN-BORCRUQBNA-N
InChICode InChI=1S/C15H20O3/c1-9-5-4-6-10(2)8-13-14(12(16)7-9)11(3)15(17)18-13/h5,8,12-14,16H,3-4,6-7H2,1-2H3/b9-5-,10-8+/t12-,13+,14+/m0/s1
SMILES C=C1C(=O)O[C@H]2/C=C(C)CC/C=C(/C)C[C@H](O)[C@@H]12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeInula britannica var.chinensis Ref.
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