input word = C00054156

Metabolite InformationStructural formula
Name 3,4-Dihydrolactucin
Formula C15H18O5
Mw 278.11542369
CAS RN 742070-89-9
C_ID C00054156
InChIKey LDPVWKYIHKNNQW-ZNOOKKGSSA-N
InChICode InChI=1S/C15H18O5/c1-6-3-9(17)12-7(2)15(19)20-14(12)13-8(5-16)4-10(18)11(6)13/h8-9,12-14,16-17H,2-5H2,1H3/t8?,9-,12+,13-,14-/m0/s1
SMILES O=C1CC(CO)[C@@]2([H])C1=C(C)C[C@H](O)[C@](C3=C)([H])[C@]2([H])OC3=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeCichorium intybus Ref.
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