input word = C00051791

Metabolite InformationStructural formula
Name Polyneuridine aldehyde
Formula C21H22N2O3
Mw 350.16304258
CAS RN
C_ID C00051791
InChIKey
InChICode InChI=1S/C21H22N2O3/c1-3-12-10-23-17-9-15(12)21(11-24,20(25)26-2)18(23)8-14-13-6-4-5-7-16(13)22-19(14)17/h3-7,11,15,17-18,22H,8-10H2,1-2H3/b12-3-/t15?,17-,18?,21+/m0/s1
SMILES c12ccccc1[nH]c1c2CC2N3[C@H]1CC(/C(=C\C)/C3)[C@]2(C(=O)OC)C=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApocynaceaeRauvolfia serpentina Ref.
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OrganismRauvolfia serpentina
ReferenceL.Yang et al.,Angew.Chem.Int.Ed.,48,(2009),1-4