input word = C00025453

Metabolite InformationStructural formula
Name Isorhoeadine
1-Isorheadine
Formula C21H21NO6
Mw 383.13688741
CAS RN 4046-21-3
C_ID C00025453 ,
InChIKey XRBIHOLQAKITPP-UJXNBJCCNA-N
InChICode InChI=1S/C21H21NO6/c1-22-6-5-11-7-15-16(26-9-25-15)8-13(11)19-18(22)12-3-4-14-20(27-10-24-14)17(12)21(23-2)28-19/h3-4,7-8,18-19,21H,5-6,9-10H2,1-2H3/t18-,19+,21+/m1/s1
SMILES c12c(cc3c(c1)CCN([C@H]1[C@H]3O[C@@H](c3c1ccc1c3OCO1)OC)C)OCO2
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr
Organism
Kingdom Family Species Reference
PlantaePapaveraceaeMeconopsis betonicifolia Ref.
PlantaePapaveraceaeMeconopsis horridula Ref.
PlantaePapaveraceaeMeconopsis napaulensis Ref.
PlantaePapaveraceaeMeconopsis rudis Prain Ref.
PlantaePapaveraceaePapaver arenarium Ref.
PlantaePapaveraceaePapaver argemone Ref.
PlantaePapaveraceaePapaver commutatum Ref.
PlantaePapaveraceaePapaver dubium Ref.
PlantaePapaveraceaePapaver oreophilum Ref.
PlantaePapaveraceaePapaver rhoeas L. Ref.
PlantaePapaveraceaePapaver rhoeas var.decaisnei Hochst.et Steud. Ref.
PlantaePapaveraceaePapaver rupifragum Boiss.et Reut Ref.
PlantaePapaveraceaePapaver syriacum Boiss.et Blanche Ref.
PlantaePapaveraceaePapaver var. flore albo Ref.
PlantaePapaveraceaePapaver var. flore pleno Ref.
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