input word = C00042009

Metabolite InformationStructural formula
Name (3'S)-Stemofolenol
(+)-(3'S)-Stemofolenol
Formula C22H27NO6
Mw 401.1838376
CAS RN 872598-64-6
C_ID C00042009 ,
InChIKey JVTGLCOWKRWBGL-OAHMIETFNA-N
InChICode InChI=1S/C22H27NO6/c1-10(24)5-7-21-14-6-8-23(21)13-9-15(21)28-22(14)16(13)11(2)18(29-22)19-17(26-4)12(3)20(25)27-19/h5,7,10-11,13-16,24H,6,8-9H2,1-4H3/b7-5+,19-18-/t10-,11-,13?,14?,15-,16-,21+,22+/m0/s1
SMILES [C@]12(/C=C/[C@H](C)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
Organism
Kingdom Family Species Reference
PlantaeStemonaceaeStemona sp. Ref.
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