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 CN1C(=N)N(C)[C@]2(C1=O)c1[nH]c3cc(Br)ccc3c1CC1(NC(N)=NC1=O)[C@H]2c1c[nH]c2cc(Br)ccc12
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr
Organism
Kingdom Family Species Reference
--Smenospongia cerebriformis Ref.
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