input word = C00047384

Metabolite InformationStructural formula
Name Aphrocallistin
Formula C20H24Br2N6O2
Mw 538.03274985
CAS RN 1096535-51-1
C_ID C00047384 ,
InChIKey ONIZXWNHLRRDOK-UHFFFAOYSA-N
InChICode InChI=1S/C20H24Br2N6O2/c1-13(29)27(2)7-5-14-9-15(21)18(16(22)10-14)30-8-4-6-23-19-17-20(25-11-24-17)28(3)12-26-19/h9-12,23H,4-8H2,1-3H3
SMILES c1c(c(c(cc1CCN(C)C(=O)C)Br)OCCCNc1ncn(c2c1ncn2)C)Br
Start Substs in Alk. Biosynthesis (Prediction) Anthranilate L-Lys L-Asp
Organism
Kingdom Family Species Reference
AnimaliaAphrocallistidaeAphrocallistes beatrix Ref.
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