input word = C00054389

Metabolite InformationStructural formula
Name Acidissiminol
Formula C25H31NO3
Mw 393.23039386
CAS RN 126006-00-6
C_ID C00054389
InChIKey FDTDKBQVKSHHIE-CAPFRKAQSA-N
InChICode InChI=1S/C25H31NO3/c1-19(2)9-14-24(27)20(3)16-18-29-23-12-10-21(11-13-23)15-17-26-25(28)22-7-5-4-6-8-22/h4-13,16,24,27H,14-15,17-18H2,1-3H3,(H,26,28)/b20-16+
SMILES CC(C)=CCC(O)/C(C)=C/COc1ccc(CCNC(=O)c2ccccc2)cc1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRutaceaeLimonia acidissima Ref.
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