input word = C00027263

Metabolite InformationStructural formula
Name 6-Acetonyldihydroavicine
8-Acetonyldihydroavicine
(-)-8-Acetonyldihydroavicine
Formula C23H19NO5
Mw 389.12632273
CAS RN 348098-59-9
C_ID C00027263 ,
InChIKey GJBHZMIAIYWRBK-UHFFFAOYNA-N
InChICode InChI=1S/C23H19NO5/c1-12(25)5-18-17-9-22-21(28-11-29-22)8-16(17)14-4-3-13-6-19-20(27-10-26-19)7-15(13)23(14)24(18)2/h3-4,6-9,18H,5,10-11H2,1-2H3/t18-/m1/s1
SMILES c12c(cc3c(c1)c1c(cc3)c3c([C@H](N1C)CC(=O)C)cc1c(c3)OCO1)OCO2
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr
Organism
Kingdom Family Species Reference
PlantaeRutaceaeZanthoxylum caudatum Ref.
PlantaeRutaceaeZanthoxylum rhoifolium Ref.
PlantaeRutaceaeZanthoxylum tetraspermum Ref.
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