input word = C00038639

Metabolite InformationStructural formula
Name Brassicicene E
(-)-Brassicicene E
Formula C23H34O7
Mw 422.23045344
CAS RN 240481-40-7
C_ID C00038639 ,
InChIKey BXZRFNRVGCBGTM-FYXKAKOBNA-N
InChICode InChI=1S/C23H34O7/c1-12(2)19-16-9-18(25)13(3)15-7-8-22(27,11-29-6)17(15)10-23(16,28)21(5,20(19)26)30-14(4)24/h10,12-13,15,18,25,27-28H,7-9,11H2,1-6H3/b17-10+/t13-,15+,18+,21+,22+,23+/m1/s1
SMILES COC[C@@]1(O)CC[C@@H]2/C1=C[C@]1(O)C(=C(C(C)C)C(=O)[C@]1(C)OC(C)=O)C[C@H](O)[C@@H]2C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiDothideomycetesAlternaria brassicicola Ref.
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