input word = C00040359

Metabolite InformationStructural formula
Name Spongotine C
(-)-Spongotine C
Formula C20H14Br2N4O
Mw 483.9534369
CAS RN 925910-75-4
C_ID C00040359 ,
InChIKey YFOAHBJMHACINK-UHFFFAOYNA-N
InChICode InChI=1S/C20H14Br2N4O/c21-10-1-3-12-14(7-23-16(12)5-10)18-9-25-20(26-18)19(27)15-8-24-17-6-11(22)2-4-13(15)17/h1-8,18,23-24H,9H2,(H,25,26)/t18-/m0/s1
SMILES O=C(C1=NCC(c2c[nH]c3cc(Br)ccc23)N1)c1c[nH]c2cc(Br)ccc12
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr
Organism
Kingdom Family Species Reference
AnimaliaHalichondriidaeSpongosorites sp. Ref.
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