input word = C00039019

Metabolite InformationStructural formula
Name Dictazoline B
Formula C26H22Br2N8O2
Mw 636.02324781
CAS RN 1036975-53-7
C_ID C00039019 ,
InChIKey OYDHIJZSLWXELA-ILMMEDEKNA-N
InChICode InChI=1S/C26H22Br2N8O2/c1-35-22(38)26(36(2)24(35)30)19(16-10-31-17-7-11(27)4-6-14(16)17)25(21(37)33-23(29)34-25)9-15-13-5-3-12(28)8-18(13)32-20(15)26/h3-8,10,19,30-32H,9H2,1-2H3,(H3,29,33,34,37)/b30-24-/t19-,25-,26+/m1/s1
SMILES c1(ccc2c(c1)[nH]c1c2C[C@]2([C@H]([C@@]31N(C(=N)N(C3=O)C)C)c1c3c([nH]c1)cc(cc3)Br)NC(=NC2=O)N)Br
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr
Organism
Kingdom Family Species Reference
--Smenospongia cerebriformis Ref.
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