input word = C00042004

Metabolite InformationStructural formula
Name (2'R)-Hydroxystemofoline
Formula C22H29NO6
Mw 403.19948767
CAS RN 872681-58-8
C_ID C00042004 ,
InChIKey WXCVDEUJZBRYIT-TXXSPWDUNA-N
InChICode InChI=1S/C22H29NO6/c1-5-12(24)9-21-14-6-7-23(21)13-8-15(21)28-22(14)16(13)10(2)18(29-22)19-17(26-4)11(3)20(25)27-19/h10,12-16,24H,5-9H2,1-4H3/b19-18-/t10-,12+,13-,14+,15-,16-,21-,22-/m0/s1
SMILES [C@@]12(C[C@@H](CC)O)[C@H]3O[C@]45[C@@H]1CCN2[C@@H](C3)[C@@H]4[C@@H](/C(=C\1/C(=C(C(=O)O1)C)OC)/O5)C
Start Substs in Alk. Biosynthesis (Prediction) L-Lys L-Arg Secologanin
Organism
Kingdom Family Species Reference
PlantaeStemonaceaeStemona sp. Ref.
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