input word = C00039018

Metabolite InformationStructural formula
Name Dictazoline A
(-)-Dictazoline A
Formula C28H26Br2N8O2
Mw 664.05454793
CAS RN 1036975-51-5
C_ID C00039018 ,
InChIKey YXJMPPIPGTWBHE-LCNPOVFMNA-N
InChICode InChI=1S/C28H26Br2N8O2/c1-35-23(39)27(37(3)25(35)31)11-17-15-7-5-14(30)10-20(15)34-22(17)28(24(40)36(2)26(32)38(28)4)21(27)18-12-33-19-9-13(29)6-8-16(18)19/h5-10,12,21,31-34H,11H2,1-4H3/b31-25-,32-26-/t21-,27+,28+/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)N(C(=N)N(C2=O)C)C)Br
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr L-Phe
Organism
Kingdom Family Species Reference
--Smenospongia cerebriformis Ref.
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OrganismSmenospongia cerebriformis
ReferenceDai,J.Nat.Prod.,71,(2008),1287