input word = C00028046

Metabolite InformationStructural formula
Name Chinese bittersweet alkaloid II
Formula C18H30N2O3
Mw 322.22564284
CAS RN 259822-70-3
C_ID C00028046 ,
InChIKey UNQFHHAPQIDJED-WXPKROIMNA-N
InChICode InChI=1S/C18H30N2O3/c1-4-5-6-8-13(2)11-14-12-23-17(15-9-7-10-19-15)20-16(14)18(21)22-3/h7,9-10,13-14,16-17,19-20H,4-6,8,11-12H2,1-3H3/t13-,14-,16+,17-/m1/s1
SMILES [C@H]1(CO[C@@H](N[C@@H]1C(=O)OC)c1ccc[nH]1)C[C@H](C)CCCCC
Start Substs in Alk. Biosynthesis (Prediction) L-Lys L-Asp
Organism
Kingdom Family Species Reference
PlantaeCelastraceaeCelastrus angulatus Ref.
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OrganismCelastrus angulatus
ReferenceWin,Phytochem.,52,(1999),1731