input word = C00026236

Metabolite InformationStructural formula
Name Adhatodine
Formula C20H21N3O2
Mw 335.16337694
CAS RN 33903-14-9
C_ID C00026236 ,
InChIKey UYHHGHQLVKQIQK-UHFFFAOYNA-N
InChICode InChI=1S/C20H21N3O2/c1-21-18-8-7-13(11-16(18)20(24)25-2)15-9-10-23-12-14-5-3-4-6-17(14)22-19(15)23/h3-8,11,15,21H,9-10,12H2,1-2H3/t15-/m0/s1
SMILES c1ccc2c(c1)N=C1N(C2)CC[C@H]1c1cc(c(cc1)NC)C(=O)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAcanthaceaeAdhatoda vasica Nees Ref.
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