input word = C00001687

Metabolite InformationStructural formula
Name Apodine
Formula C21H22N2O4
Mw 366.15795721
CAS RN 57932-86-2
C_ID C00001687 ,
InChIKey SXLKMYFJLWDXFU-PSNZFWMSNA-N
InChICode InChI=1S/C21H22N2O4/c1-26-18(25)12-10-20-11-16(24)27-15(20)6-8-23-9-7-21(19(20)23)13-4-2-3-5-14(13)22-17(12)21/h2-5,15,19,22H,6-11H2,1H3/t15-,19-,20-,21-/m0/s1
SMILES c1cccc2c1[C@@]13C(=C(C[C@@]45[C@@H]1N(CC3)CC[C@@H]4OC(=O)C5)C(=O)OC)N2
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Secologanin
Organism
Kingdom Family Species Reference
PlantaeApocynaceaeTabernaemontana apoda Ref.
PlantaeApocynaceaeTabernaemontana armenica Ref.
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