input word = C00025912

Metabolite InformationStructural formula
Name 16R,19E-Isositsirikine
Isositsirikine
Formula C21H26N2O3
Mw 354.19434271
CAS RN 6519-27-3
C_ID C00025912 ,
InChIKey RGXKJLTVROJBKZ-XVZPXBACNA-N
InChICode InChI=1S/C21H26N2O3/c1-3-13-11-23-9-8-15-14-6-4-5-7-18(14)22-20(15)19(23)10-16(13)17(12-24)21(25)26-2/h3-7,16-17,19,22,24H,8-12H2,1-2H3/b13-3-/t16-,17-,19-/m0/s1
SMILES C/C=C1/CN2CCc3c([nH]c4ccccc34)[C@@H]2C[C@@H]1[C@H](CO)C(=O)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApocynaceaeAlstonia angustifolia Ref.
PlantaeApocynaceaeAlstonia angustifolia var.latifolia Ref.
PlantaeApocynaceaeAlstonia angustiloba Ref.
PlantaeApocynaceaeCatharanthus roseus Ref.
PlantaeApocynaceaeMelodinus insulae-pinorum Boiteau. Ref.
PlantaeApocynaceaeTabernaemontana pachysiphon Stapf. Ref.
PlantaeApocynaceaeVinca rosea L. Ref.
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