input word = C00025147

Metabolite InformationStructural formula
Name 3-Isorauniticine pseudoindoxyl
Formula C21H24N2O4
Mw 368.17360727
CAS RN 88335-34-6
C_ID C00025147 ,
InChIKey PXVFCFIYPGUUNJ-SYDNXPPINA-N
InChICode InChI=1S/C21H24N2O4/c1-12-15-10-23-8-7-21(19(24)13-5-3-4-6-17(13)22-21)18(23)9-14(15)16(11-27-12)20(25)26-2/h3-6,11-12,14-15,18,22H,7-10H2,1-2H3/t12-,14+,15+,18+,21+/m1/s1
SMILES COC(=O)C1=CO[C@H](C)[C@@H]2CN3CCC4(Nc5ccccc5C4=O)[C@@H]3C[C@H]12
Start Substs in Alk. Biosynthesis (Prediction) Secologanin
Organism
Kingdom Family Species Reference
PlantaeRubiaceaeUncaria elliptica R.Br.ex G.Don. Ref.
zoom in