input word = C00025009

Metabolite InformationStructural formula
Name Spirasine X
Formula C20H25NO2
Mw 311.18852905
CAS RN 112543-29-0
C_ID C00025009 ,
InChIKey KDLHFMQCQFBHRZ-AALWFAOPNA-N
InChICode InChI=1S/C20H25NO2/c1-9-6-19-7-10-15-18(2)4-3-5-20(15)16(19)14(23)11(9)13(22)12(19)17(20)21(10)8-18/h10-13,15-17,22H,1,3-8H2,2H3/t10-,11-,12+,13-,15+,16+,17+,18-,19-,20-/m0/s1
SMILES C=C1CC23C[C@H]4[C@@H]5[C@@]6(C)CCC[C@]57C([C@H]2C(O)[C@H]1C(=O)[C@H]37)N4C6
Start Substs in Alk. Biosynthesis (Prediction) L-Pro L-Lys L-Arg Cholesterol
Organism
Kingdom Family Species Reference
PlantaeRosaceaeSpiraea japonica Ref.
zoom in