input word = C00021147

Metabolite InformationStructural formula
Name Neopulchellidine
Formula C20H33NO4
Mw 351.24095855
CAS RN 28513-27-1
C_ID C00021147 ,
InChIKey UVTMIMFWBAITTB-ONYYYZBVNA-N
InChICode InChI=1S/C20H33NO4/c1-12-8-16-13(10-20(2)17(23)9-15(22)18(12)20)14(19(24)25-16)11-21-6-4-3-5-7-21/h12-18,22-23H,3-11H2,1-2H3/t12-,13-,14+,15+,16-,17-,18-,20-/m1/s1
SMILES [C@@H]12[C@](C[C@H]3[C@@H](C[C@H]1C)OC(=O)[C@H]3CN1CCCCC1)([C@@H](C[C@@H]2O)O)C
Start Substs in Alk. Biosynthesis (Prediction) L-Pro L-Lys L-Arg Cholesterol
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeGaillardia pulchella Ref.
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