input word = C00024516

Metabolite InformationStructural formula
Name Aspidochibine
AQC2
Formula C19H22N2O3
Mw 326.16304258
CAS RN 139955-86-5
C_ID C00024516 ,
InChIKey YUPRHHFLOLUPFG-UHFFFAOYNA-N
InChICode InChI=1S/C19H22N2O3/c1-2-19-8-7-15-13(12-5-3-4-6-14(12)21-15)9-17(22)24-16(10-19)18(23)20-11-19/h3-6,16,21H,2,7-11H2,1H3,(H,20,23)/t16-,19+/m1/s1
SMILES CCC12CCc3[nH]c4ccccc4c3CC(=O)OC(C1)C(=O)NC2
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Secologanin
Organism
Kingdom Family Species Reference
PlantaeApocynaceaeAspidosperma quebracho-blanco Ref.
PlantaeApocynaceaeAspidosperma quebrachoblanco Ref.
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OrganismAspidosperma quebracho-blanco
ReferenceAimi,N.et al.,Tet.Lett.,32,(1991),4949