input word = C00025414

Metabolite InformationStructural formula
Name Ibophyllidine N-oxide

Ibophyllidine Nb-oxide
Formula C20H24N2O3
Mw 340.17869265
CAS RN 76190-14-2
C_ID C00025414 ,
InChIKey AXSYFWYZSRVBFV-FHGJLHSTNA-N
InChICode InChI=1S/C20H24N2O3/c1-3-13-10-12-11-14(19(23)25-2)17-20(8-9-22(13,24)18(12)20)15-6-4-5-7-16(15)21-17/h4-7,12-13,18,21H,3,8-11H2,1-2H3/t12-,13-,18-,20-,22+/m1/s1
SMILES c1ccc2c(c1)[C@@]13C(=C(C[C@@H]4[C@H]3N(=O)([C@@H](C4)CC)CC1)C(=O)OC)N2
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Secologanin
Organism
Kingdom Family Species Reference
PlantaeApocynaceaeTabernaemontana flavicans Ref.
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OrganismTabernaemontana flavicans
ReferenceAchenbach,Z.Naturforsch Teil B 35,(1980),1465