input word = C00025015

Metabolite InformationStructural formula
Name Spiratine A
Formula C22H33NO3
Mw 359.24604393
CAS RN 334865-86-0
C_ID C00025015 ,
InChIKey RFWLUFWNDMEYFX-LQJJMHSPNA-N
InChICode InChI=1S/C22H33NO3/c1-14-15-4-7-22(19(14)26)17(10-15)21-6-3-5-20(2,16(21)11-18(22)25)12-23(13-21)8-9-24/h9,15-19,25-26H,1,3-8,10-13H2,2H3/t15-,16+,17-,18+,19-,20-,21-,22+/m0/s1
SMILES C=C1[C@H]2CC[C@@]3([C@H](O)C[C@@H]4[C@@]5(C)CCC[C@@]4(CN(CC=O)C5)[C@@H]3C2)[C@H]1O
Start Substs in Alk. Biosynthesis (Prediction) L-Pro L-Arg Cholesterol
Organism
Kingdom Family Species Reference
PlantaeRosaceaeSpiraea japonica var.acuta Ref.
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