input word = C00051981

Metabolite InformationStructural formula
Name 4-Hydroxycanadaline
Formula C21H23NO6
Mw 385.15253747
CAS RN
C_ID C00051981
InChIKey DMCPJHSSJZFYFZ-MRXNPFEDSA-N
InChICode InChI=1S/C21H23NO6/c1-22-5-4-12-8-18-19(28-11-27-18)9-14(12)16(22)6-13-7-17(24)21(26-3)20(25-2)15(13)10-23/h7-10,16,24H,4-6,11H2,1-3H3/t16-/m1/s1
SMILES CN1CCC(C=C(OCO2)C2=C3)=C3[C@H]1CC4=C(C([H])=O)C(OC)=C(OC)C(O)=C4
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePapaveraceaePapaver somniferum Ref.
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