input word = C00011694

Metabolite InformationStructural formula
Name [R-(R*,R*)]-4-(1-Isocyanato-1,5-dimethyl-4-hexenyl)-1-methyl-cyclohexene
Formula C16H25NO
Mw 247.19361443
CAS RN 105281-35-4
C_ID C00011694 ,
InChIKey FYJDWZLUQLPLNO-REIYMHPCNA-N
InChICode InChI=1S/C16H25NO/c1-13(2)6-5-11-16(4,17-12-18)15-9-7-14(3)8-10-15/h6-7,15H,5,8-11H2,1-4H3/t15-,16+/m0/s1
SMILES C1C[C@H](CC=C1C)[C@](CCC=C(C)C)(C)N=C=O
Start Substs in Alk. Biosynthesis (Prediction) L-Pro L-Arg
Organism
Kingdom Family Species Reference
AnimaliaHalichondriidaeCiocalypta sp. Ref.
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OrganismCiocalypta sp.
ReferenceGulavita,J.Org.Chem.,51,(1986),5136