input word = C00049996

Metabolite InformationStructural formula
Name Aplykurodinone B
Formula C20H30O3
Mw 318.21949482
CAS RN 142780-50-5
C_ID C00049996 ,
InChIKey LILRNUJDHJYEPR-UHFFFAOYNA-N
InChICode InChI=1S/C20H30O3/c1-12(2)6-5-7-13(3)15-11-17-19-14(10-18(22)23-17)16(21)8-9-20(15,19)4/h6,13-15,17,19H,5,7-11H2,1-4H3/t13-,14+,15+,17+,19-,20+/m0/s1
SMILES CC(C)=CCCC(C)C1CC2OC(=O)CC3C(=O)CCC1(C)C23
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
AnimaliaAplysiidaeAplysia fasciata Ref.
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OrganismAplysia fasciata
ReferenceOrtega,J.Nat.Prod.,60,(1997),488