input word = C00026411

Metabolite InformationStructural formula
Name Cupreine
Desmethylquinine
O-Demethylquinine
O6'-Demethylquinine
Ultraquinine
Formula C19H22N2O2
Mw 310.16812796
CAS RN 524-63-0
C_ID C00026411 ,
InChIKey ONIPOSXLSBFFOM-CCUXPIRGNA-N
InChICode InChI=1S/C19H22N2O/c1-2-13-12-21-8-6-14(13)9-16(21)10-15-5-7-20-19-4-3-17(22)11-18(15)19/h2-5,7,11,13-14,16,22H,1,6,8-10,12H2/t13-,14-,16-/m0/s1
SMILES c1cc(cc2c1nccc2C[C@@H]1C[C@H]2[C@H](CN1CC2)C=C)O
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Secologanin
Organism
Kingdom Family Species Reference
PlantaeRubiaceaeGuettarda noumeana Ref.
PlantaeRubiaceaeRemijia pedunculata Ref.
PlantaeRubiaceaeRemijia peruviana Ref.
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OrganismRemijia peruviana
ReferenceNatural Products Vol.1 ISBN978-3-642-22143-9