input word = C00049402

Metabolite InformationStructural formula
Name Spongiacidin A
Formula C11H9Br2N5O2
Mw 400.91230037
CAS RN 206433-68-3
C_ID C00049402 ,
InChIKey ZITKTAJHKVYGTC-ZZXKWVIFSA-N
InChICode InChI=1S/C11H9Br2N5O2/c12-5-4-3(6-10(20)18-11(14)17-6)1-2-15-9(19)7(4)16-8(5)13/h16H,1-2H2,(H,15,19)(H3,14,17,18,20)/b6-3+
SMILES C\1(=C\2/C(=O)N=C(N2)N)/CCNC(=O)c2c1c(c([nH]2)Br)Br
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr L-Asp
Organism
Kingdom Family Species Reference
--Stylissa carteri Ref.
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