input word = C00047954

Metabolite InformationStructural formula
Name Knightol acetate
Formula C22H34O3
Mw 346.25079495
CAS RN 1187084-40-7
C_ID C00047954 ,
InChIKey SQOZKUOMCHPMST-HWDXCQLUNA-N
InChICode InChI=1S/C22H34O3/c1-16(2)20-11-8-17(3)7-6-14-22(5)21(25-22)13-10-19(9-12-20)15-24-18(4)23/h7,9,20-21H,1,6,8,10-15H2,2-5H3/b17-7+,19-9+/t20-,21+,22+/m0/s1
SMILES C=C(C)[C@@H]1C/C=C(COC(C)=O)CC[C@H]2O[C@]2(C)CC/C=C(C)CC1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Eunicea knighti Ref.
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