input word = C00028654

Metabolite InformationStructural formula
Name N-Deethyldelphatine
Formula C24H39NO7
Mw 453.27265261
CAS RN 173559-78-9
C_ID C00028654 ,
InChIKey MNNMFOYTLQAHNQ-UHFFFAOYNA-N
InChICode InChI=1S/C24H39NO7/c1-28-11-21-7-6-15(30-3)23-13-8-12-14(29-2)9-22(26,16(13)17(12)31-4)24(27,20(23)25-10-21)19(32-5)18(21)23/h12-20,25-27H,6-11H2,1-5H3/t12-,13-,14+,15-,16-,17+,18+,19+,20-,21-,22-,23-,24+/m0/s1
SMILES COCC12CCC(OC)C34C5CC6C(OC)CC(O)(C5C6OC)C(O)(C(OC)C13)C4NC2
Start Substs in Alk. Biosynthesis (Prediction) L-Pro L-Arg Secologanin Cholesterol
Organism
Kingdom Family Species Reference
PlantaeRanunculaceaeAconitum orientale Mill Ref.
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