input word = C00054390

Metabolite InformationStructural formula
Name Acidissiminol epoxide
Formula C25H31NO4
Mw 409.22530849
CAS RN 139165-01-8
C_ID C00054390
InChIKey QQKKFVXSQXUHPI-NBVRZTHBSA-N
InChICode InChI=1S/C25H31NO4/c1-18(22(27)17-23-25(2,3)30-23)14-16-29-21-11-9-19(10-12-21)13-15-26-24(28)20-7-5-4-6-8-20/h4-12,14,22-23,27H,13,15-17H2,1-3H3,(H,26,28)/b18-14+
SMILES C/C(C(O)CC(O1)C1(C)C)=CCOC2=CC=C(CCNC(C3=CC=CC=C3)=O)C=C2
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRutaceaeLimonia acidissima Ref.
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