input word = C00024963

Metabolite InformationStructural formula
Name Spiradine C
Formula C22H29NO3
Mw 355.2147438
CAS RN 19741-52-7
C_ID C00024963 ,
InChIKey DWUXLTHMRXTVCJ-UHFFFAOYNA-N
InChICode InChI=1S/C22H29NO3/c1-11-8-20-9-22(25)18-19(3)5-4-6-21(18)16(20)15(26-12(2)24)13(11)7-14(20)17(21)23(22)10-19/h13-18,25H,1,4-10H2,2-3H3/t13-,14-,15+,16-,17-,18-,19+,20+,21+,22-/m0/s1
SMILES [C@@]12([C@H]3[C@]4(CN2[C@@H]2[C@]3([C@@H]3[C@@]5(C1)CC(=C)[C@@H]([C@H]3OC(=O)C)C[C@@H]25)CCC4)C)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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