input word = C00025198

Metabolite InformationStructural formula
Name Pseudoakuammigine
Deoxyakuammine
Formula C22H26N2O3
Mw 366.19434271
CAS RN 2447-70-3
C_ID C00025198 ,
InChIKey HAGBWVNSVWLTKY-ZSXUKORENA-N
InChICode InChI=1S/C22H26N2O3/c1-4-14-12-24-10-9-21-15-7-5-6-8-17(15)23(2)22(21)18(24)11-16(14)20(21,13-27-22)19(25)26-3/h4-8,16,18H,9-13H2,1-3H3/b14-4+/t16-,18-,20-,21-,22+/m0/s1
SMILES c1ccc2c(c1)N([C@]13[C@]42CCN2[C@H]1C[C@@H](/C(=C/C)/C2)[C@@]4(CO3)C(=O)OC)C
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Secologanin
Organism
Kingdom Family Species Reference
PlantaeApocynaceaeAlstonia scholaris R.Br. Ref.
PlantaeApocynaceaeAlstonia yunnanensis Ref.
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OrganismAlstonia scholaris R.Br.
ReferenceBoonchuay,Phytochem.,15,(1976),821

Boonchuay,Planta Med.,29,(1976),380