input word = C00028474

Metabolite InformationStructural formula
Name Lipopurealin A
Formula C31H48Br2N6O4
Mw 726.21037986
CAS RN 101488-81-7
C_ID C00028474 ,
InChIKey GKUJVGYRWHGSBN-NOACJBATSA-N
InChICode InChI=1S/C31H48Br2N6O4/c1-2-3-4-5-6-7-8-9-10-11-12-14-28(40)35-16-13-18-43-29-25(32)19-23(20-26(29)33)21-27(39-42)30(41)36-17-15-24-22-37-31(34)38-24/h19-20,22,42H,2-18,21H2,1H3,(H,35,40)(H,36,41)(H3,34,37,38)/b39-27-
SMILES c1(ncc([nH]1)CCNC(=O)/C(=N\O)/Cc1cc(c(c(c1)Br)OCCCNC(=O)CCCCCCCCCCCCC)Br)N
Start Substs in Alk. Biosynthesis (Prediction) L-Lys
Organism
Kingdom Family Species Reference
--Oscillatoria agardhii Ref.
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