input word = C00026566

Metabolite InformationStructural formula
Name Isobromotopsentin
Formula C20H12Br2N4O
Mw 481.93778683
CAS RN 206008-06-2
C_ID C00026566 ,
InChIKey RSGZGJXKRHURTQ-UHFFFAOYSA-N
InChICode InChI=1S/C20H12Br2N4O/c21-10-1-3-12-14(7-23-16(12)5-10)18-9-25-20(26-18)19(27)15-8-24-17-6-11(22)2-4-13(15)17/h1-9,23-24H,(H,25,26)
SMILES O=C(c1ncc(-c2c[nH]c3cc(Br)ccc23)[nH]1)c1c[nH]c2cc(Br)ccc12
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr
Organism
Kingdom Family Species Reference
AnimaliaHalichondriidaeSpongosorites sp. Ref.
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