input word = C00028731

Metabolite InformationStructural formula
Name Norroehybridine
(-)-N-Demethylroehybridine
Formula C30H37N3O5
Mw 519.27332131
CAS RN 131690-43-2
C_ID C00028731 ,
InChIKey PYRCODHRAYBZGZ-WMYMEIONNA-N
InChICode InChI=1S/C30H37N3O5/c1-35-21-12-18-17-6-10-32-30(28(17)33-19(18)13-22(21)36-2)8-7-29(15-24(30)38-4)14-20-25-16(5-9-31-20)11-23(37-3)27(34)26(25)29/h11-13,20,24,31-34H,5-10,14-15H2,1-4H3/t20-,24+,29+,30+/m0/s1
SMILES c12c(CCN[C@@]31[C@@H](C[C@]1(CC3)c3c4[C@H](C1)NCCc4cc(c3O)OC)OC)c1c([nH]2)cc(c(c1)OC)OC
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr
Organism
Kingdom Family Species Reference
PlantaePapaveraceaeRoemeria hybrida Ref.
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