input word = C00024514

Metabolite InformationStructural formula
Name Apodinine
14-Hydroxyapodine
Formula C21H22N2O5
Mw 382.15287183
CAS RN 77017-02-8
C_ID C00024514 ,
InChIKey FPVJHGGYOOWMOZ-UHFFFAOYNA-N
InChICode InChI=1S/C21H22N2O5/c1-27-18(26)11-8-20-9-15(25)28-17(20)14(24)10-23-7-6-21(19(20)23)12-4-2-3-5-13(12)22-16(11)21/h2-5,14,17,19,22,24H,6-10H2,1H3/t14-,17-,19+,20-,21+/m0/s1
SMILES c1ccc2c(c1)[C@]13C(=C(C[C@@]45[C@H]1N(C[C@@H]([C@@H]4OC(=O)C5)O)CC3)C(=O)OC)N2
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Secologanin
Organism
Kingdom Family Species Reference
PlantaeApocynaceaeTabernaemontana apoda Ref.
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