input word = C00028155

Metabolite InformationStructural formula
Name Delbrunine
Formula C25H39NO7
Mw 465.27265261
CAS RN 106982-83-6
C_ID C00028155 ,
InChIKey MSIFWQXGXCPJTR-UHFFFAOYNA-N
InChICode InChI=1S/C25H39NO7/c1-5-26-10-22(11-29-2)7-6-16(27)24-14-8-13-15(30-3)9-23(17(14)18(13)28)25(21(24)26,33-12-32-23)20(31-4)19(22)24/h13-21,27-28H,5-12H2,1-4H3/t13-,14-,15+,16+,17-,18-,19+,20+,21-,22-,23-,24-,25+/m0/s1
SMILES [C@H]12[C@]34[C@@H]([C@@H]5[C@](CN1CC)(CC[C@H]([C@]25[C@@H]1[C@@H]2[C@]3(C[C@H]([C@@H]([C@@H]2O)C1)OC)OCO4)O)COC)OC
Start Substs in Alk. Biosynthesis (Prediction) L-Arg Secologanin
Organism
Kingdom Family Species Reference
PlantaeRanunculaceaeDelphinium caeruleum Jacq.ex.Cambss. Ref.
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OrganismDelphinium caeruleum Jacq.ex.Cambss.
ReferenceWang,Chin.Chem.Lett.,7,(1996),139

Wang,Phytochem.,42,(1996),569