input word = C00025013

Metabolite InformationStructural formula
Name Spirasine XIV
Formula C20H27NO2
Mw 313.20417911
CAS RN 115610-48-5
C_ID C00025013 ,
InChIKey ZEHGKQGMRGFJOC-ROGOZQKHNA-N
InChICode InChI=1S/C20H27NO2/c1-10-7-18-8-20(23)16-17(2)4-3-5-19(16)12(18)6-11(10)14(22)13(18)15(19)21(20)9-17/h11-16,22-23H,1,3-9H2,2H3/t11-,12+,13+,14+,15+,16+,17-,18+,19-,20+/m0/s1
SMILES [C@]12(C[C@@]34[C@@H]5[C@@H]([C@H](C(=C)C4)C[C@H]3[C@]34[C@@H]5N1C[C@@](CCC3)(C)[C@@H]24)O)O
Start Substs in Alk. Biosynthesis (Prediction) L-Pro L-Lys L-Arg Cholesterol
Organism
Kingdom Family Species Reference
PlantaeRosaceaeSpiraea japonica Ref.
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