input word = C00038637

Metabolite InformationStructural formula
Name Brassicicene C
(-)-Brassicicene C
Formula C21H32O4
Mw 348.23005951
CAS RN 240481-36-1
C_ID C00038637 ,
InChIKey JYZGDIADQSQUAG-UDGPYKPJNA-N
InChICode InChI=1S/C21H32O4/c1-11(2)19-16-9-18(22)12(3)14-6-7-21(24,10-25-5)17(14)8-15(16)13(4)20(19)23/h8,11-15,18,22,24H,6-7,9-10H2,1-5H3/b17-8+/t12-,13+,14+,15+,18+,21+/m1/s1
SMILES [C@H]1([C@H]2C(=C[C@@H]3C(=C(C(=O)[C@H]3C)C(C)C)C[C@@H]1O)[C@](CC2)(COC)O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiDothideomycetesAlternaria brassicicola Ref.
zoom in