input word = C00038636

Metabolite InformationStructural formula
Name Brassicicene B
(-)-Brassicicene B
Formula C21H34O4
Mw 350.24570957
CAS RN 240481-34-9
C_ID C00038636 ,
InChIKey LJCHDOYLNWEGEZ-DZSCKFBLNA-N
InChICode InChI=1S/C21H34O4/c1-12(2)15-8-19(23)20(4)10-17-14(6-7-21(17,24)11-25-5)13(3)18(22)9-16(15)20/h10,12-14,18-19,22-24H,6-9,11H2,1-5H3/b17-10+/t13-,14+,18+,19+,20?,21+/m1/s1
SMILES COC[C@@]1(O)CC[C@@H]2/C1=C[C@]1(C)C(=C(C(C)C)C[C@@H]1O)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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